SCHEMBL9701272

SCHEMBL9701272

CCc1cc2c(C)ccnc2n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 7/20 0.44
AGTR2 P50052 7/20 0.44

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
SCHEMBL9702808 0.93 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL9701118 0.91 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9701434 0.87 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL9702671 0.84 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9702254 0.82 AGTR1 (0.40) AGTR1AGTR2
SCHEMBL8567083 0.81 AGTR1 (0.61) AGTR1AGTR2
SCHEMBL9702879 0.81 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL9701240 0.80 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL8972305 0.80 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9701125 0.80 AGTR1 (0.51) AGTR1AGTR2

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
EP-0497516-A1 Substituted pyrrolo-fused 6-membered heterocycles as angiotensin II antagonists MERCK & CO. INC. (US) 1992-08-05 EP disclosed
US-5124335-A Hypotensive agents, antiglaucoma agents MERCK & CO., INC. (US) 1992-06-23 US disclosed