SCHEMBL11209121

SCHEMBL11209121

Cc1cccc(CC=Cc2nc[nH]c2C)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
IDO1 P14902 2/20 0.40
PIN1 Q13526 1/20 0.40
TAAR1 Q96RJ0 2/20 0.38
CYP11B1 P15538 2/20 0.37
CYP11B2 P19099 2/20 0.37
ALDH1A1 P00352 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
MAOB P27338 2/20 0.35
DAO P14920 1/20 0.35
MAPK14 Q16539 1/20 0.35
MAOA P21397 1/20 0.35

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
SCHEMBL11209978 0.86 MAOB (0.45) TAAR1MAOB
SCHEMBL11209965 0.86 MAOB (0.45) TAAR1MAOB
SCHEMBL11204108 0.83 ALOX5 (0.41) IDO1PIN1TDP1
SCHEMBL11207361 0.78 ACP1 (0.42) LMNATAAR1TDP1NPSR1
SCHEMBL11211229 0.77 SMN1; SMN2 (0.51) LMNA
SCHEMBL11266744 0.75 IDO1 (0.39) LMNAHPGDALOX15IDO1PIN1
SCHEMBL11205137 0.75 PARP1 (0.36) TAAR1
SCHEMBL30189580 0.72 PTGS1 (0.49) IDO1TAAR1TDP1MAOBMAOA
SCHEMBL31298991 0.72 PTGS1 (0.49) IDO1TAAR1TDP1MAOBMAOA
SCHEMBL1610979 0.70 IDO1 (0.50) IDO1TAAR1CYP11B1CYP11B2TDP1

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