SCHEMBL9302215

SCHEMBL9302215

CC(SSc1nc2ccccc2[nH]1)c1ccc(C(=O)N(C)C2CCCCC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 1/20 0.44
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
ITK Q08881 1/20 0.42
TXN P10599 1/20 0.42
POLB P06746 3/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
LMNA P02545 3/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
HTT P42858 1/20 0.41
APEX1 P27695 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
TDP1 Q9NUW8 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
SCHEMBL9302140 0.90 SMN1; SMN2 (0.47) PTAFRKMT2AMEN1ITKTXN
SCHEMBL9302162 0.84 SMN1; SMN2 (0.47) PTAFRKMT2AMEN1ITKTXN
SCHEMBL9302074 0.82 PTAFR (0.46) PTAFRKMT2AMEN1ITKPOLB
SCHEMBL9301867 0.82 SMN1; SMN2 (0.53) PTAFRKMT2AMEN1ITKPOLB
SCHEMBL9301659 0.79 KMT2A (0.46) KMT2AMEN1POLBSMN1; SMN2LMNA
SCHEMBL9302149 0.78 AR (0.55) PTAFRKMT2AMEN1POLBSMN1; SMN2
SCHEMBL9303194 0.77 PTAFR (0.48) PTAFRKMT2AMEN1ITKPOLB
SCHEMBL9302077 0.77 AR (0.55) PTAFRKMT2AMEN1POLBSMN1; SMN2
SCHEMBL18924427 0.75 KDM4E (0.56) PTAFRKMT2AMEN1ITKPOLB
SCHEMBL9302033 0.75 HPGD (0.60) PTAFRKMT2AMEN1ITKPOLB

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