Benzimidazole

Benzimidazole

SCHEMBL7020475

Clc1cc2nc(Br)[nH]c2cc1Cl.c1ccc2[nH]cnc2c1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.42
RAB9A P51151 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 2/20 0.41
MAPT P10636 2/20 0.39
RHEB Q15382 3/20 0.38
HTT P42858 2/20 0.38
GAA P10253 1/20 0.38
KDM4E B2RXH2 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
CASP6 P55212 2/20 0.37
USP2 O75604 1/20 0.37
POLB P06746 1/20 0.37
TNNI3 P19429 1/20 0.37
TNNT2 P45379 1/20 0.37
TNNC1 P63316 1/20 0.37
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL441602 0.80 GAA (0.53) RAB9AMEN1KMT2ANPC1RHEB
SCHEMBL30860105 0.80 GAA (0.53) RAB9AMEN1KMT2ANPC1RHEB
Benzimidazole SCHEMBL28467044 0.75 SMN1; SMN2 (0.45) RAB9ANPC1MAPTHTTGAA
Benzimidazole SCHEMBL29408372 0.73
Benzimidazole SCHEMBL29358377 0.73
Benzimidazole SCHEMBL461969 0.73 SMN1; SMN2 (0.50) RAB9ANPC1MAPTHTTGAA
Benzimidazole SCHEMBL10931770 0.73 SMN1; SMN2 (0.50) RAB9ANPC1MAPTHTTGAA
Benzimidazole SCHEMBL6009 0.73
Anthracene SCHEMBL175144 0.71 KDM4E (0.47) RAB9ANPC1MAPTHTTGAA
Naphthalene SCHEMBL15819597 0.71 KDM4E (0.46) RAB9ANPC1MAPTHTTGAA

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-1272473-A1 PROCESS FOR PREPARING SUBSTITUTED BENZIMIDAZOLE COMPOUNDS GLAXO GROUP LIMITED (GB) 2003-01-08 EP disclosed
WO-2001077083-A1 PROCESS FOR PREPARING SUBSTITUTED BENZIMIDAZOLE COMPOUNDS GLAXO GROUP LIMITED (GB) 2001-10-18 WO disclosed
EP-0994890-A2 BENZIMIDAZOLE DERIVATIVES GLAXO GROUP LIMITED (GB) 2000-04-26 EP disclosed
WO-1998056761-A2 BENZIMIDAZOLE DERIVATIVES GLAXO GROUP LIMITED (GB) 1998-12-17 WO disclosed