SCHEMBL698918

SCHEMBL698918

Cc1[c]c(Cl)cc(C(F)(F)F)c1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 2/20 0.35
ALDH1A1 P00352 1/20 0.34
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
HIF1A Q16665 1/20 0.34
TXNRD1 Q16881 1/20 0.34
TXNRD3 Q86VQ6 1/20 0.34
TXNRD2 Q9NNW7 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GABRB3 P28472 4/20 0.32
GPR35 Q9HC97 3/20 0.32
GABRA2 P47869 3/20 0.32
GABRB2 P47870 3/20 0.32
PDE2A O00408 1/20 0.32
CES2 O00748 1/20 0.31
XPO1 O14980 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
SCHEMBL455828 0.84 RAPGEF4 (0.38) RAPGEF4ALDH1A1CYP3A4HPGDALOX15
SCHEMBL147478 0.84 ALDH1A1 (0.40) RAPGEF4ALDH1A1CYP3A4HPGDALOX15
SCHEMBL697818 0.83
SCHEMBL698230 0.79
SCHEMBL697742 0.76 ALDH1A1 (0.35) ALDH1A1CYP3A4HPGDALOX15TSHR
SCHEMBL1531107 0.76 ALDH1A1 (0.35) ALDH1A1CYP3A4HPGDALOX15TSHR
SCHEMBL147500 0.74 ALDH1A1 (0.34) ALDH1A1CYP3A4HPGDALOX15TSHR
SCHEMBL7821427 0.74 GABRP (0.36) ALDH1A1CYP3A4HPGDALOX15TSHR
SCHEMBL4194881 0.71 RAPGEF4 (0.31) RAPGEF4GABRB3GABRA2GABRB2
SCHEMBL4195232 0.71 RAPGEF4 (0.34) RAPGEF4GABRB3GPR35GABRA2GABRB2

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0511845-B1 Pesticidal 1-aryl-5-(substituted alkylideneimino)-pyrazoles AVENTIS CROPSCIENCE SA (FR) 2001-10-31 EP claimed
US-5556873-A AGRICULTURAL PESTICIDES RHONE-POULENC INC. (US) 1996-09-17 US claimed
US-5321040-A Pesticidal 1-aryl-5-(substituted N-cinnamylideneimino) pyrazoles RHONE-POULENC INC. (US) 1994-06-14 US claimed
US-5236938-A Pesticidal 1-aryl-5-(substituted alkylideneimino)pyrazoles RHONE-POULENC INC. (US) 1993-08-17 US claimed
EP-0511845-A1 Pesticidal 1-aryl-5-(substituted alkylideneimino)-pyrazoles RHONE-POULENC AGROCHIMIE (FR) 1992-11-04 EP claimed
EP-2423188-B1 Intermediates in the preparation of agricultural/horticultural insecticides and method for using the same MITSUI CHEMICALS AGRO INC (JP) 2021-03-10 EP disclosed
EP-1661886-B1 INSECTICIDE FOR AGRICULTURAL OR HORTICULTURAL USE AND METHOD OF USE THEREOF MITSUI CHEMICALS AGRO INC (JP) 2016-08-10 EP disclosed
US-9101135-B2 Agricultural/horticultural insecticide and method for using the same MITSUI CHEMICALS, INC. (JP) 2015-08-11 US disclosed
US-9089133-B2 Insecticide for agricultural or horticultural use and method of use thereof MITSUI CHEMICALS, INC. (JP) 2015-07-28 US disclosed
US-20140303377-A1 AGRICULTURAL/HORTICULTURAL INSECTICIDE AND METHOD FOR USING THE SAME MITSUI CHEMICALS, INC. (JP) 2014-10-09 US disclosed
US-8816128-B2 Insecticide for agricultural or horticultural use and method of use thereof MITSUI CHEMICALS, INC. (JP) 2014-08-26 US disclosed
US-20130066114-A1 INSECTICIDE FOR AGRICULTURAL OR HORTICULTURAL USE AND METHOD OF USE THEREOF MITSUI CHEMICALS, INC. (JP) 2013-03-14 US disclosed
EP-1661886-A1 INSECTICIDE FOR AGRICULTURAL OR HORTICULTURAL USE AND METHOD OF USE THEREOF Mitsui Chemicals, Inc. (JP) 2006-05-31 EP disclosed
US-20060105969-A1 Anthelmintic compositions BRUCE CHRISTOPHER I 2006-05-18 US disclosed
EP-0511845-B1 Pesticidal 1-aryl-5-(substituted alkylideneimino)-pyrazoles AVENTIS CROPSCIENCE SA (FR) 2001-10-31 EP disclosed
US-5556873-A AGRICULTURAL PESTICIDES RHONE-POULENC INC. (US) 1996-09-17 US disclosed
US-5360910-A Pesticidal 1-aryl-5-(substituted alkylideneimino)pyrazoles RHONE-POULENC AG COMPANY (US) 1994-11-01 US disclosed
US-5321040-A Pesticidal 1-aryl-5-(substituted N-cinnamylideneimino) pyrazoles RHONE-POULENC INC. (US) 1994-06-14 US disclosed
US-5236938-A Pesticidal 1-aryl-5-(substituted alkylideneimino)pyrazoles RHONE-POULENC INC. (US) 1993-08-17 US disclosed
EP-0511845-A1 Pesticidal 1-aryl-5-(substituted alkylideneimino)-pyrazoles RHONE-POULENC AGROCHIMIE (FR) 1992-11-04 EP 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 (3 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-20140303377-A1 AGRICULTURAL/HORTICULTURAL INSECTICIDE AND METHOD FOR USING THE SAME CBR3, ATL3, CNPY2 RAPGEF4 3961/4885ALDH1A1 1956/4885CYP3A4 166/4885
US-20060105969-A1 Anthelmintic compositions TUBB, TUBA3C, CYP51A1 RAPGEF4 4004/4885ALDH1A1 1903/4885CYP3A4 220/4885
US-20130066114-A1 INSECTICIDE FOR AGRICULTURAL OR HORTICULTURAL USE AND METHOD OF USE THEREOF CYP2C8, CYP4F8, CYP3A7 RAPGEF4 3173/4885ALDH1A1 184/4885CYP3A4 16/4885

“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.