SCHEMBL9554135

SCHEMBL9554135

CCCCc1c(C(F)F)n(C(=O)CCC)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 13/20 0.42
AGTR2 P50052 13/20 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
SCHEMBL9554517 0.97 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL9554222 0.95 AGTR1 (0.39) AGTR1AGTR2
SCHEMBL9553860 0.94 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL9538967 0.94 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL9533424 0.92 AGTR1 (0.37) AGTR1AGTR2
SCHEMBL9535383 0.92 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL9535201 0.91 AGTR1 (0.39) AGTR1AGTR2
SCHEMBL9531640 0.91 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL9534406 0.90 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL9534210 0.90 AGTR1 (0.38) 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