SCHEMBL6536066

SCHEMBL6536066

CCCc1nc(C(F)(F)F)c(CO)n1Cc1ccc(-c2ccccc2)c(-c2nnn[nH]2)c1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.44
AGTR2 P50052 3/20 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
SCHEMBL10533864 0.94 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL287 0.90 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL7171699 0.88 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL459 0.85 AGTR1 (0.52) AGTR1AGTR2
SCHEMBL317 0.84 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL9328849 0.84 AGTR1 (0.64) AGTR1AGTR2
SCHEMBL9558411 0.83 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL7175115 0.82 AGTR2 (0.49) AGTR1AGTR2
SCHEMBL7366694 0.82 AGTR1 (0.56) AGTR1AGTR2
SCHEMBL9207303 0.82 AGTR1 (0.46) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0754042-A4 TREATMENT OF ATHEROSCLEROSIS WITH ANGIOTENSIN II RECEPTOR BLOCKING IMIDAZOLES MERCK & CO INC (US) 2004-06-23 EP disclosed
EP-0754042-A1 TREATMENT OF ATHEROSCLEROSIS WITH ANGIOTENSIN II RECEPTOR BLOCKING IMIDAZOLES MERCK & CO. INC. (US) 1997-01-22 EP disclosed
WO-1995026188-A1 TREATMENT OF ATHEROSCLEROSIS WITH ANGIOTENSIN II RECEPTOR BLOCKING IMIDAZOLES MERCK & CO., INC. (US) 1995-10-05 WO disclosed