SCHEMBL9854307

SCHEMBL9854307

N#Cc1ccccc1-c1ccc(Cn2c(C3CC3)nc3cccnc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.49
AGTR1 P30556 4/20 0.48
AGTR2 P50052 4/20 0.48
CNR2 P34972 1/20 0.42
PRKAG1 P54619 3/20 0.40
PRKAA1 Q13131 3/20 0.40
PRKAB1 Q9Y478 3/20 0.40
NOS1 P29475 1/20 0.40
NOS2 P35228 1/20 0.40
BRD4 O60885 1/20 0.39
LMNA P02545 1/20 0.39
MLNR O43193 1/20 0.39
AKT1 P31749 1/20 0.39
ALOX5AP P20292 1/20 0.38
ACHE P22303 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
GAA P10253 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
SCHEMBL9854316 0.95 PPARG (0.47) PPARGAGTR1AGTR2CNR2PRKAG1
SCHEMBL8872236 0.83 AGTR1 (0.69) PPARGAGTR1AGTR2CNR2PRKAG1
SCHEMBL9854386 0.83 PPARG (0.53) PPARGAGTR1AGTR2CNR2PRKAG1
SCHEMBL9854319 0.82 BRD4 (0.53) PPARGAGTR1AGTR2CNR2BRD4
SCHEMBL8566073 0.81 PPARG (0.61) PPARGAGTR1AGTR2BRD4LMNA
SCHEMBL9853637 0.80 PPARG (0.74) PPARGAGTR1AGTR2LMNA
SCHEMBL8874596 0.79 PPARG (0.53) PPARGAGTR1AGTR2BRD4LMNA
SCHEMBL9854355 0.79 PPARG (0.53) PPARGAGTR1AGTR2LMNARXFP1
SCHEMBL9851543 0.78 AGTR1 (0.66) PPARGAGTR1AGTR2LMNAACHE
SCHEMBL8359612 0.78 AGTR1 (0.51) PPARGAGTR1AGTR2

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-0426021-A1 Condensed imidazole derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-05-08 EP disclosed