SCHEMBL5772246

SCHEMBL5772246

Cc1cc(C)c(C)c(C(=C=O)C(=O)Cl)c1C

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL7811949 0.80 TAS1R3 (0.35) ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL6838601 0.78 ALDH1A1 (0.32) ALDH1A1SMN1; SMN2
SCHEMBL3256843 0.77 ALDH1A1 (0.31) ALDH1A1SMN1; SMN2
SCHEMBL4678894 0.76 BCHE (0.33) ALDH1A1HPGDSMN1; SMN2
SCHEMBL7479979 0.74 HTT (0.34) ALDH1A1LMNAHPGD
SCHEMBL6308979 0.74 KMT2A (0.38) NPC1ALDH1A1LMNASMN1; SMN2
SCHEMBL3676493 0.74 SMN1; SMN2 (0.33) ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL6838898 0.74 HTT (0.38) NPC1ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL1312119 0.73 ALDH1A1 (0.37) NPC1ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL2461457 0.72 SMURF2 (0.31)

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101851244-B Substituted phenyl keto enols as pesticides and herbicides BAYER AG 2013-08-21 CN disclosed
CN-101851244-A The phenyl keto-enol pesticide and the weedicide that replace BAYER AG 2010-10-06 CN disclosed
CN-101580465-A Substituted phenyl keto enols as pesticides and herbicides BAYER AG (DE) 2009-11-18 CN disclosed
CN-101575312-A Substituted phenyl keto enols as pesticides and herbicides BAYER AG (DE) 2009-11-11 CN disclosed
EP-1721522-A2 Substituted phenylketo-enoles as biocides and herbicides Bayer CropScience AG (DE) 2006-11-15 EP disclosed
CN-1631879-A Substituted phenyl keto enols as pesticides and herbicides BAYER AG (DE) 2005-06-29 CN disclosed
CN-1535956-A Substituted phenyl keto-enol pesticide and weedicide 2004-10-13 CN disclosed
US-6486343-B1 Substituted phenyl keto enols as pesticides and herbicides BAYER AKTIENGESELLSCHAFT (DE) 2002-11-26 US disclosed
US-6388123-B1 MITICIDE, INSECTICIDE FOR PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2002-05-14 US disclosed
US-6271180-B2 INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-08-07 US disclosed
US-20010004629-A1 Substituted phenyl keto enols as pesticides and herbicides LIEB VOLKER (DE) 2001-06-21 US disclosed
US-6140358-A FOR CONTROLLING PESTS AND WEEDS BAYER AKTIENGESELLSCHAFT (DE) 2000-10-31 US disclosed
CN-1215390-A Substituted phenyl ketoenol pesticides and herbicides BAYER AG (DE) 1999-04-28 CN disclosed
EP-0891330-A1 SUBSTITUTED PHENYL KETO ENOLS AS PESTICIDES AND HERBICIDES BAYER AG (DE) 1999-01-20 EP disclosed
WO-1997036868-A1 SUBSTITUTED PHENYL KETO ENOLS AS PESTICIDES AND HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-10-09 WO 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 (1 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-20010004629-A1 Substituted phenyl keto enols as pesticides and herbicides DDT, CYP4X1, CYP1B1 NPC1 4013/4885ALDH1A1 652/4885LMNA 3471/4885

“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.