SCHEMBL9015133

SCHEMBL9015133

Cc1ccc(-c2ccc(C(F)(F)F)[nH]2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.46
HPGD P15428 3/20 0.46
USP2 O75604 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ALDH1A1 P00352 3/20 0.42
GAA P10253 2/20 0.42
GLA P06280 1/20 0.42
ATM Q13315 1/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
MAPT P10636 2/20 0.42
LMNA P02545 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
HSD17B2 P37059 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39

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
SCHEMBL13417158 0.82 HPGD (0.47) KDM4EHPGDUSP2HSD17B10ALDH1A1
SCHEMBL7784928 0.80 GCGR (0.50) KDM4EHPGDALDH1A1GAAGLA
SCHEMBL7214808 0.79 KDM4E (0.43) KDM4EHPGDHSD17B10ALDH1A1GAA
SCHEMBL6309866 0.78 HPGD (0.59) KDM4EHPGDUSP2HSD17B10ALDH1A1
SCHEMBL12918686 0.72 HPGD (0.53) KDM4EHPGDUSP2HSD17B10ALDH1A1
SCHEMBL3294173 0.69 KDM4E (0.37) KDM4EHPGDALDH1A1MEN1KMT2A
SCHEMBL22315193 0.69 HMBS (0.50) KDM4EHPGDMAPTHSD17B2
SCHEMBL17868402 0.68 DGAT1 (0.53) NPBWR1
SCHEMBL5352040 0.68 SMN1; SMN2 (0.56) KDM4EHPGDALDH1A1GAAGLA
SCHEMBL10222198 0.68 SCN2A (0.44) CCNB2CDK1CCNB1GSK3AGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0487870-B1 Insecticidal and acaricidal diarylpyrrolecarbonitrile and diarylnitropyrrole compounds AMERICAN CYANAMID CO (US) 1996-12-18 EP claimed
EP-0487870-A2 Insecticidal and acaricidal diarylpyrrolecarbonitrile and diarylnitropyrrole compounds AMERICAN CYANAMID COMPANY (US) 1992-06-03 EP claimed
EP-0487870-B1 Insecticidal and acaricidal diarylpyrrolecarbonitrile and diarylnitropyrrole compounds AMERICAN CYANAMID CO (US) 1996-12-18 EP disclosed
EP-0487870-A2 Insecticidal and acaricidal diarylpyrrolecarbonitrile and diarylnitropyrrole compounds AMERICAN CYANAMID COMPANY (US) 1992-06-03 EP disclosed