SCHEMBL9565589

SCHEMBL9565589

Cc1cc(-c2nccc3ccccc23)cc2[nH]cnc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.42
▸ KDM4E B2RXH2 4/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ NPC1 O15118 3/20 0.42
▸ RAB9A P51151 3/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ GLA P06280 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ PRNP P04156 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ CYP2A6 P11509 1/20 0.41
▸ DYRK1A Q13627 1/20 0.38
▸ CCNB2 O95067 1/20 0.38
▸ CDK1 P06493 1/20 0.38
▸ CCNB1 P14635 1/20 0.38
▸ CCNA2 P20248 1/20 0.38

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
SCHEMBL11976472 0.78 CYP2A6 (0.52) MAPTKDM4EKMT2ANPC1RAB9A
SCHEMBL9562909 0.76 NPC1 (0.46) MAPTKDM4EKMT2ANPC1RAB9A
SCHEMBL12385418 0.75 MEN1 (0.44) MAPTKDM4EKMT2AALDH1A1HPGD
SCHEMBL9562898 0.75 NPC1 (0.45) MAPTKDM4EKMT2ANPC1RAB9A
SCHEMBL11976477 0.74 CYP2A6 (0.50) MAPTKDM4EKMT2ANPC1RAB9A
SCHEMBL30360258 0.74 CYP2A6 (0.53) MAPTKDM4EKMT2ANPC1RAB9A
SCHEMBL5468265 0.74 CYP2A6 (0.53) MAPTKDM4EKMT2ANPC1RAB9A
SCHEMBL4439497 0.74 CYP2A6 (0.53) MAPTKDM4EKMT2ANPC1RAB9A
Hydrochloric Acid SCHEMBL6007561 0.72 CYP2A6 (0.52) MAPTKDM4EKMT2ANPC1RAB9A
SCHEMBL30011331 0.72 CYP2A6 (0.52) MAPTKDM4EKMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0543263-A2 Benziimidazoles, pharmaceuticals containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1993-05-26 — — EP disclosed
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