SCHEMBL9302327

SCHEMBL9302327

CC1(Cc2ccc(S(=O)(=O)NCc3ccccc3Cl)cc2)Nc2ccccc2N1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.56
ALDH1A1 P00352 2/20 0.56
HPGD P15428 1/20 0.56
MAPK1 P28482 1/20 0.50
HTR2C P28335 1/20 0.47
HTR2B P41595 1/20 0.47
NAMPT P43490 1/20 0.46
LMNA P02545 2/20 0.44
KMT2A Q03164 2/20 0.44
TP53 P04637 3/20 0.43
MAPT P10636 2/20 0.43
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43
NPC1 O15118 1/20 0.40

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
SCHEMBL9304262 0.86 ALDH1A1 (0.54) POLBALDH1A1MAPK1NAMPTLMNA
SCHEMBL9301975 0.82 CYP19A1 (0.54) POLBNAMPTTP53
SCHEMBL9303638 0.76 SMN1; SMN2 (0.52) ALDH1A1MAPK1LMNAMAPTHTT
SCHEMBL5960083 0.76 KMT2A (0.72) POLBALDH1A1HPGDMAPK1HTR2C
SCHEMBL12793683 0.76 POLB (0.72) POLBALDH1A1HPGDMAPK1HTR2C
SCHEMBL9302813 0.75 ALDH1A1 (0.48) ALDH1A1MAPK1LMNAKMT2AMEN1
SCHEMBL4662993 0.75 POLB (0.70) POLBALDH1A1HPGDMAPK1HTR2C
SCHEMBL29660878 0.75 POLB (0.70) POLBALDH1A1HPGDMAPK1HTR2C
SCHEMBL9303510 0.74 ALOX15 (0.53) ALDH1A1NAMPTLMNAKMT2ATP53
SCHEMBL9303870 0.73 CA2 (0.47) MAPT

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