SCHEMBL7024699

SCHEMBL7024699

FC(F)(F)Oc1cc(Cl)[c]c(Br)c1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.32
NOTUM Q6P988 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
MPI P34949 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL261330 0.86 GPR3 (0.36) GPR3NOTUMHDAC3HDAC1HDAC2
SCHEMBL458002 0.86 GPR3 (0.36) GPR3
SCHEMBL7823502 0.78 GPR3 (0.32) GPR3NOTUM
SCHEMBL698159 0.77 GPR3 (0.33) GPR3NOTUM
SCHEMBL9224313 0.71 GPR3 (0.35) GPR3NOTUMHDAC3HDAC1HDAC2
SCHEMBL147500 0.69 ALDH1A1 (0.34) NOTUM
SCHEMBL1361401 0.69 TRPV1 (0.37)
SCHEMBL457802 0.69
SCHEMBL456301 0.69 HDAC3 (0.31) HDAC3HDAC1HDAC2HDAC6
SCHEMBL1360496 0.69 ALDH1A1 (0.45)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 45 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6638956-B2 Pesticidal 1-arylpyrazoles RHONE-POULENC, INC. 2003-10-28 US claimed
US-6593328-B2 Said compounds for the control of arthropod, nematode, helminth or protozoan pests, in particular to the application of said compounds or compositions in agricultural methods of use, particularly as pesticides, for controlling arthropods, RHONE-POULENC INC. 2003-07-15 US claimed
US-20030092680-A1 Novel pesticides WU TAI-TEH (US) 2003-05-15 US claimed
US-6500848-B2 INSECTICIDE, NEMATODICES, ANTIPROTOZOA AGENTS; VETERINARY MEDICINE RHONE-POULENC INC. 2002-12-31 US claimed
US-20020173492-A1 Novel pesticides WU TAI-TEH (US) 2002-11-21 US claimed
US-6376520-B1 INSECTICIDES, NEMATOCIDES RHONE-POULENC, INC. 2002-04-23 US claimed
US-20020045758-A1 Pesticidal 1-arylpyrazoles RHONE-POULENC INC. 2002-04-18 US claimed
US-6350771-B1 Pesticidal 1-arylpyrazoles RHONE-POULENC, INC. 2002-02-26 US claimed
US-6346522-B1 1-ARYLPYRAZOLES; SYSTEMIC PESTICIDES, INSECTICIDES, LARVICIDES, MITICIDES, ANTIPROTOZOA, AND ANTHELMINTIC AGENTS; AGRICULTURE, HORTICULTURE, ANIMAL HUSBANDRY, PUBLIC HEALTH AND VETERINARY MEDICINE RHONE-POULENC, INC. 2002-02-12 US claimed
US-20020016468-A1 PESTICIDAL 1-ARYLPYRAZOLE DERIVATIVES RHONE-POULENC AGROCHIMIE (FR) 2002-02-07 US claimed
US-6277848-B1 Pesticides RHONE-POULENC, INC. 2001-08-21 US claimed
US-6107314-A INSECTICIDES, NEMATOCIDES, PARASITICIDES RHONE-POULENC INC. (US) 2000-08-22 US claimed
EP-0948487-A1 PESTICIDAL 1-ARYL AND PYRIDYLPYRAZOLE DERIVATIVES RHONE-POULENC AGROCHIMIE (FR) 1999-10-13 EP claimed
US-5914335-A INSECTICIDES RHONE-POULENC INC. (US) 1999-06-22 US claimed
EP-0911329-A1 3-Substituted arylpyrazole derivatives RHONE-POULENC AGRO (FR) 1999-04-28 EP claimed
WO-1998028279-A1 PESTICIDAL 1-ARYL AND PYRIDYLPYRAZOLE DERIVATIVES RHONE-POULENC AGROCHIMIE (FR) 1998-07-02 WO claimed
EP-0839809-A1 Pesticidal 1-arylpyrazole-5-sulfinilimine derivatives RHONE-POULENC AGROCHIMIE (FR) 1998-05-06 EP claimed
US-5691333-A APPLYING TO CONTROL ARTHROPODS AND NEMATODES RHONE-POULENC INC. (US) 1997-11-25 US claimed
US-5629335-A Pesticidal 1-arylpyrazole-3-carboximidothioic acid esters RHONE-POULENC INC. (US) 1997-05-13 US claimed
US-20030144251-A1 Pesticidal 1-arylpyrazoles RHONE-POULENC INC. 2003-07-31 US disclosed
US-6593328-B2 Said compounds for the control of arthropod, nematode, helminth or protozoan pests, in particular to the application of said compounds or compositions in agricultural methods of use, particularly as pesticides, for controlling arthropods, RHONE-POULENC INC. 2003-07-15 US disclosed
US-20030092680-A1 Novel pesticides WU TAI-TEH (US) 2003-05-15 US disclosed
US-6500850-B2 1-ARYLPYRAZOLE OXIME DERIVATIVES; SAFE SYSTEMIC INSECTICIDES FOR CONTROL OF ARTHROPOD, NEMATODE, HELMINTH OR PROTOZOAN PESTS RHONE-POULENC INC. 2002-12-31 US disclosed
US-6500848-B2 INSECTICIDE, NEMATODICES, ANTIPROTOZOA AGENTS; VETERINARY MEDICINE RHONE-POULENC INC. 2002-12-31 US disclosed
US-20020173492-A1 Novel pesticides WU TAI-TEH (US) 2002-11-21 US disclosed
EP-0948485-B1 PESTICIDAL 1-ARYLPYRAZOLES AVENTIS CROPSCIENCE SA (FR) 2002-09-25 EP disclosed
US-6432997-B1 SYSTEMIC INSECTICIDES, NEMATOCIDES, LARVICIDES, MITICIDES, AND ANTHELMINTICS; AGRICULTURE, HORTICULTURE RHONE-POULENC, INC. 2002-08-13 US disclosed
US-6376520-B1 INSECTICIDES, NEMATOCIDES RHONE-POULENC, INC. 2002-04-23 US disclosed
US-20020045758-A1 Pesticidal 1-arylpyrazoles RHONE-POULENC INC. 2002-04-18 US disclosed
US-6350771-B1 Pesticidal 1-arylpyrazoles RHONE-POULENC, INC. 2002-02-26 US disclosed
US-6346522-B1 1-ARYLPYRAZOLES; SYSTEMIC PESTICIDES, INSECTICIDES, LARVICIDES, MITICIDES, ANTIPROTOZOA, AND ANTHELMINTIC AGENTS; AGRICULTURE, HORTICULTURE, ANIMAL HUSBANDRY, PUBLIC HEALTH AND VETERINARY MEDICINE RHONE-POULENC, INC. 2002-02-12 US disclosed
US-20020016468-A1 PESTICIDAL 1-ARYLPYRAZOLE DERIVATIVES RHONE-POULENC AGROCHIMIE (FR) 2002-02-07 US disclosed
US-6277848-B1 Pesticides RHONE-POULENC, INC. 2001-08-21 US disclosed
US-6107314-A INSECTICIDES, NEMATOCIDES, PARASITICIDES RHONE-POULENC INC. (US) 2000-08-22 US disclosed
US-6008353-A PESTICIDE, INSECTICIDE, NEMATOCIDE, PARACITISIDE RHONE-POULENC INC. (US) 1999-12-28 US disclosed
US-5981565-A ARYLPYRAZOLE HYDROXYLAMINES AND HYDRAZINES; FOR CONTROLLING ARTHROPODS, ESPECIALLY INSETS, BY SYSTEMIC ACTION RHONE-POULENC INC. (US) 1999-11-09 US disclosed
EP-0948485-A1 PESTICIDAL 1-ARYLPYRAZOLES RHONE-POULENC AGROCHIMIE (FR) 1999-10-13 EP disclosed
EP-0948487-A1 PESTICIDAL 1-ARYL AND PYRIDYLPYRAZOLE DERIVATIVES RHONE-POULENC AGROCHIMIE (FR) 1999-10-13 EP disclosed
US-5914335-A INSECTICIDES RHONE-POULENC INC. (US) 1999-06-22 US disclosed
EP-0911329-A1 3-Substituted arylpyrazole derivatives RHONE-POULENC AGRO (FR) 1999-04-28 EP disclosed
WO-1998028278-A1 PESTICIDAL 1-ARYLPYRAZOLES RHONE-POULENC AGROCHIMIE (FR) 1998-07-02 WO disclosed
WO-1998028279-A1 PESTICIDAL 1-ARYL AND PYRIDYLPYRAZOLE DERIVATIVES RHONE-POULENC AGROCHIMIE (FR) 1998-07-02 WO disclosed
EP-0839809-A1 Pesticidal 1-arylpyrazole-5-sulfinilimine derivatives RHONE-POULENC AGROCHIMIE (FR) 1998-05-06 EP disclosed
US-5691333-A APPLYING TO CONTROL ARTHROPODS AND NEMATODES RHONE-POULENC INC. (US) 1997-11-25 US disclosed
US-5629335-A Pesticidal 1-arylpyrazole-3-carboximidothioic acid esters RHONE-POULENC INC. (US) 1997-05-13 US disclosed
US-5629335-A Pesticidal 1-arylpyrazole-3-carboximidothioic acid esters RHONE-POULENC INC. (US) 1997-05-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020173492-A1 Novel pesticides DDT, ACHE, PTMS GPR3 1789/4885NOTUM 157/4885HDAC3 659/4885
US-20020045758-A1 Pesticidal 1-arylpyrazoles CYP1B1, CYP2E1, CYP1A1 GPR3 1191/4885NOTUM 421/4885HDAC3 380/4885
US-20030144251-A1 Pesticidal 1-arylpyrazoles CYP1B1, CYP2E1, CYP1A1 GPR3 1191/4885NOTUM 421/4885HDAC3 380/4885
US-20020016468-A1 PESTICIDAL 1-ARYLPYRAZOLE DERIVATIVES DDT, NAT1, CYP2E1 GPR3 263/4885NOTUM 431/4885HDAC3 24/4885
US-20030092680-A1 Novel pesticides DDT, ACHE, PTMS GPR3 1789/4885NOTUM 157/4885HDAC3 659/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.