SCHEMBL9303510

SCHEMBL9303510

CC1(Cc2ccc(S(=O)(=O)Nc3cccc(Cl)c3)cc2)Nc2ccccc2N1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.53
MGAT2 Q10469 1/20 0.52
LIMK2 P53671 3/20 0.50
CYP19A1 P11511 1/20 0.49
PKM P14618 3/20 0.48
ALDH1A1 P00352 3/20 0.48
TSHR P16473 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C19 P33261 1/20 0.48
LIMK1 P53667 2/20 0.48
PGR P06401 2/20 0.47
NAMPT P43490 2/20 0.47
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
THRB P10828 1/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
GPR27 Q9NS67 1/20 0.44

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
SCHEMBL9302374 0.84 CACNA1B (0.53) LIMK2CYP19A1PKMALDH1A1PGR
SCHEMBL9301975 0.83 CYP19A1 (0.54) CYP19A1CYP1A2CYP3A4CYP2C19NAMPT
SCHEMBL9302425 0.83 ITGA1 (0.58) ALDH1A1NAMPTMAPTMEN1KMT2A
SCHEMBL9302410 0.80 LMNA (0.56) ALOX15PKMALDH1A1TSHRCYP1A2
SCHEMBL9302429 0.78 TP53 (0.45) ALOX15CYP19A1PKMALDH1A1NAMPT
SCHEMBL9304262 0.78 ALDH1A1 (0.54) CYP19A1ALDH1A1CYP1A2CYP3A4NAMPT
SCHEMBL9303027 0.76 CXCR4 (0.45) ALDH1A1LMNATP53MAPTMEN1
SCHEMBL9305039 0.75 CYP19A1 (0.67) ALOX15LIMK2CYP19A1PKMALDH1A1
SCHEMBL3791521 0.74 PGR (0.81) ALOX15CYP19A1PKMALDH1A1TSHR
SCHEMBL9302327 0.74 POLB (0.56) ALDH1A1NAMPTLMNATP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0468971-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-02-05 EP claimed
WO-1990009997-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-09-07 WO claimed
US-5314880-A Platelet activating factor antagonist BRITISH BIO-TECHNOLOGY LIMITED (GB) 1994-05-24 US disclosed
EP-0468971-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-02-05 EP disclosed
WO-1990009997-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-09-07 WO disclosed