SCHEMBL10372181

SCHEMBL10372181

COc1cc(C)ncc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.43
SLC6A2 P23975 3/20 0.41
SLC6A4 P31645 3/20 0.41
SLC6A3 Q01959 2/20 0.41
SMPD3 Q9NY59 1/20 0.40
CHEK2 O96017 1/20 0.39
FYN P06241 1/20 0.39
MAOA P21397 3/20 0.39
SLC22A6 Q4U2R8 1/20 0.38
SLC22A8 Q8TCC7 1/20 0.38
MEN1 O00255 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
APP P05067 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
PDE10A Q9Y233 1/20 0.37
TRPA1 O75762 1/20 0.37
TRIM24 O15164 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL19004905 0.83 SMPD3 (0.40) MAOBSLC6A2SLC6A4SLC6A3SMPD3
SCHEMBL1054720 0.79 ALDH1A1 (0.46) SLC6A2SLC6A4SLC6A3SMN1; SMN2PDE10A
SCHEMBL15132113 0.78 MAOB (0.43) MAOBFYNSLC22A6SLC22A8MEN1
SCHEMBL4128579 0.77 UHRF1 (0.43) SLC6A2SLC6A4SLC6A3PDE10AALDH1A1
SCHEMBL24816680 0.77 MAOB (0.42) MAOBFYNSLC22A6SLC22A8MEN1
SCHEMBL17143195 0.77 MAOB (0.42) MAOBSLC22A6SLC22A8MEN1RAB9A
SCHEMBL28888359 0.77 MAOB (0.42) MAOBCHEK2SLC22A6SLC22A8MEN1
SCHEMBL29214455 0.77 NOS3 (0.44) MAOBCHEK2FYNAPP
SCHEMBL107611 0.76 IDO1 (0.40) SLC6A2SLC6A4SLC6A3KMT2AAPP
SCHEMBL29953594 0.75 ENPP2 (0.41) SLC6A2SLC6A4SLC6A3SMPD3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0390842-A1 NOVEL BENZIMIDAZOLE DERIVATIVES Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1990-10-10 EP disclosed
WO-1989005299-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1989-06-15 WO disclosed