SCHEMBL9095477

SCHEMBL9095477

CCc1nc2c(C)cc(C)nc2n1Cc1cccc2ccc(-c3ccccc3-c3nnn[nH]3)nc12

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.48
AGTR2 P50052 2/20 0.48
GPR4 P46093 2/20 0.44
PPARG P37231 1/20 0.42

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
SCHEMBL8914997 0.85 AGTR1 (0.53) AGTR1AGTR2GPR4PPARG
L-158809 SCHEMBL683357 0.81 AGTR2 (0.71) AGTR1AGTR2GPR4
L-158809 SCHEMBL7944169 0.80 AGTR2 (0.70) AGTR1AGTR2GPR4
SCHEMBL9200041 0.78 AGTR1 (0.55) AGTR1AGTR2GPR4
SCHEMBL9282165 0.78
SCHEMBL9282159 0.77 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL8913647 0.77 AGTR1 (0.52) AGTR1AGTR2GPR4
SCHEMBL9202793 0.77 AGTR2 (0.51) AGTR1AGTR2GPR4
SCHEMBL8741166 0.76 AGTR2 (0.61) AGTR1AGTR2GPR4PPARG
SCHEMBL9662500 0.76 AGTR1 (0.51) AGTR1AGTR2GPR4

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-0569013-B1 Quinoline compounds as angiotensin II antagonists GREEN CROSS CORP (JP) 1996-08-28 EP claimed