SCHEMBL9554183

SCHEMBL9554183

CCCc1c(C(F)F)n(C(C)C)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 7/20 0.42
AGTR2 P50052 7/20 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
SCHEMBL9530098 0.95 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9531278 0.93 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9554324 0.92 AGTR1 (0.38) AGTR1AGTR2
SCHEMBL9555169 0.90 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL9530064 0.90 AGTR1 (0.40) AGTR1AGTR2
SCHEMBL9536768 0.89 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9554006 0.89 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9534527 0.89 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL9036548 0.89 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL9531409 0.89 AGTR1 (0.42) 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
US-5238952-A Treating glaucoma disorders G. D. SEARLE & CO. (US) 1993-08-24 US disclosed
US-5087634-A N-substituted imidazol-2-one compounds for treatment of circulatory disorders G. D. SEARLE & CO. (US) 1992-02-11 US disclosed