SCHEMBL9302162

SCHEMBL9302162

CN(C(=O)c1ccc(C(Sc2nc3ccccc3[nH]2)c2ccccc2)cc1)C1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.47
PTAFR P25105 1/20 0.45
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
ITK Q08881 1/20 0.43
POLB P06746 3/20 0.42
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
APEX1 P27695 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CCR5 P51681 2/20 0.41
TXN P10599 1/20 0.41
ALDH1A1 P00352 3/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
MAPK1 P28482 1/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 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 0.89 SMN1; SMN2 (0.47) SMN1; SMN2PTAFRKMT2AMEN1ITK
SCHEMBL9302074 0.87 PTAFR (0.46) SMN1; SMN2PTAFRKMT2AMEN1ITK
SCHEMBL9302215 0.84 PTAFR (0.44) SMN1; SMN2PTAFRKMT2AMEN1ITK
SCHEMBL9301867 0.81 SMN1; SMN2 (0.53) SMN1; SMN2PTAFRKMT2AMEN1ITK
SCHEMBL9303194 0.80 PTAFR (0.48) SMN1; SMN2PTAFRKMT2AMEN1ITK
SCHEMBL9302149 0.79 AR (0.55) SMN1; SMN2PTAFRKMT2AMEN1POLB
SCHEMBL9301659 0.77 KMT2A (0.46) SMN1; SMN2KMT2AMEN1POLBLMNA
SCHEMBL9302077 0.77 AR (0.55) SMN1; SMN2PTAFRKMT2AMEN1POLB
SCHEMBL9302176 0.77 PTAFR (0.45) SMN1; SMN2PTAFRKMT2AMEN1ITK
SCHEMBL18924427 0.76 KDM4E (0.56) SMN1; SMN2PTAFRKMT2AMEN1ITK

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