SCHEMBL9521547

SCHEMBL9521547

CN(C)CCc1nc2ccccc2[nH]1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.66
DDAH1 O94760 1/20 0.61
BCHE P06276 2/20 0.60
NPC1 O15118 1/20 0.60
RAB9A P51151 1/20 0.60
PDE10A Q9Y233 2/20 0.56
ACHE P22303 1/20 0.56
CHRM1 P11229 1/20 0.55
PKM P14618 1/20 0.54
HTT P42858 1/20 0.54

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
SCHEMBL9521781 0.90 POLB (0.72) POLBDDAH1BCHENPC1RAB9A
SCHEMBL9519818 0.89 POLB (0.75) POLBDDAH1BCHENPC1RAB9A
SCHEMBL9518566 0.87 POLB (0.73) POLBDDAH1BCHENPC1RAB9A
SCHEMBL230157 0.83 POLB (0.84) POLBDDAH1BCHENPC1RAB9A
SCHEMBL4118942 0.82 BCHE (0.69) POLBDDAH1BCHENPC1RAB9A
SCHEMBL135294 0.80 POLB (0.72) POLBDDAH1BCHENPC1RAB9A
SCHEMBL29749508 0.80 DDAH1 (0.72) POLBDDAH1NPC1RAB9APDE10A
SCHEMBL612507 0.80 DDAH1 (0.72) POLBDDAH1NPC1RAB9APDE10A
SCHEMBL30677880 0.80 POLB (0.72) POLBDDAH1BCHENPC1RAB9A
SCHEMBL10769383 0.80 SMN1; SMN2 (0.60) DDAH1BCHENPC1RAB9AACHE

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-0350467-B1 Pharmacologically active benzimidazole derivatives DOMPE FARMACEUTICI SPA (IT) 1993-12-29 EP disclosed
US-4971980-A ANTIHISTAMINES DOMPE FARMACEUTICI S.P.A. (IT) 1990-11-20 US disclosed
EP-0350467-A1 Pharmacologically active benzimidazole derivatives DOMPE' FARMACEUTICI S.p.A. (IT) 1990-01-10 EP disclosed
EP-0226016-A1 Process for inhibiting hydrogen-induced corrosion of metallic materials BAYER AG (DE) 1987-06-24 EP disclosed