SCHEMBL11209147

SCHEMBL11209147

Clc1cccc(CC=Cc2c[nH]cn2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.38
CYP3A4 P08684 2/20 0.38
AGXT P21549 2/20 0.38
PNMT P11086 2/20 0.38
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
HTR3A P46098 1/20 0.36
HTR3D Q70Z44 1/20 0.36
HTR3C Q8WXA8 1/20 0.36
ACP1 P24666 1/20 0.36
CDC7 O00311 3/20 0.36
DBF4 Q9UBU7 3/20 0.36
TAAR1 Q96RJ0 1/20 0.36
BRD4 O60885 1/20 0.36
DAO P14920 1/20 0.34
BACE1 P56817 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34
PIN1 Q13526 1/20 0.34
MAOA P21397 1/20 0.34

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
SCHEMBL6528671 0.85 PNMT (0.40) IDO1CYP3A4AGXTPNMTHTR3E
SCHEMBL11266744 0.84 IDO1 (0.39) IDO1TAAR1DAOPIN1MAOA
SCHEMBL11208194 0.82 MAOB (0.47) MAOB
SCHEMBL11208197 0.82 MAOB (0.47) MAOB
SCHEMBL11202432 0.80 IDO1 (0.43) IDO1AGXTCDC7DBF4TAAR1
SCHEMBL11273357 0.78 ACP1 (0.35) ACP1TAAR1
SCHEMBL11205166 0.73 AGXT (0.32) IDO1AGXT
SCHEMBL11225024 0.73 KDM4E (0.32)
SCHEMBL11215797 0.72
SCHEMBL10744133 0.72 ACP1 (0.35) ACP1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0034474-B1 SUBSTITUTED IMIDAZOLES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME Farmos-Yhtyma Oy (FI) 1983-01-26 EP disclosed
US-4333947-A HYPOTENSIVE AGENTS, BACTERICIDES, FUNGICIDES FARMOS-YHTYMA OY (FI) 1982-06-08 US disclosed
EP-0034474-A1 Substituted imidazoles, their preparation and pharmaceutical compositions containing the same Farmos-Yhtyma Oy (FI) 1981-08-26 EP disclosed