SCHEMBL11266744

SCHEMBL11266744

Cc1cccc(CC=Cc2c[nH]cn2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.39
TAAR1 Q96RJ0 2/20 0.37
LMNA P02545 2/20 0.36
HPGD P15428 2/20 0.35
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
PSMD14 O00487 1/20 0.35
CYP1A2 P05177 1/20 0.35
AGTR1 P30556 1/20 0.35
CYP2C19 P33261 1/20 0.35
OPRK1 P41145 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALOX15 P16050 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
MAOB P27338 2/20 0.34
DAO P14920 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
SCHEMBL11209147 0.84 IDO1 (0.38) IDO1TAAR1MAOBDAOMAOA
SCHEMBL11202432 0.83 IDO1 (0.43) IDO1TAAR1HRH3MAOB
SCHEMBL11205166 0.83 AGXT (0.32) IDO1
SCHEMBL11208197 0.83 MAOB (0.47) MAOB
SCHEMBL11208194 0.83 MAOB (0.47) MAOB
SCHEMBL10744133 0.79 ACP1 (0.35) TAAR1
SCHEMBL11209273 0.78 TNF (0.33)
SCHEMBL11225024 0.77 KDM4E (0.32) KDM4EL3MBTL1
SCHEMBL11210877 0.75 PTGER1 (0.33)
SCHEMBL11235805 0.75 TAAR1 (0.36) TAAR1HPGDALDH1A1MEN1KMT2A

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
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