SCHEMBL9554366

SCHEMBL9554366

CCCCC(=O)n1c(C(OC)OC)c(CCC(C)C)n(Cc2ccc(-c3ccccc3-c3nnn[nH]3)cc2)c1=O

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 5/20 0.39
AGTR2 P50052 5/20 0.39
PPARG P37231 2/20 0.37

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
SCHEMBL9553790 0.96 AGTR1 (0.36) AGTR1AGTR2
SCHEMBL9553507 0.94 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL9554550 0.94 AGTR1 (0.40) AGTR1AGTR2
SCHEMBL9554882 0.93 AGTR1 (0.35) AGTR1AGTR2PPARG
SCHEMBL9535201 0.91 AGTR1 (0.39) AGTR1AGTR2
SCHEMBL9531640 0.91 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL9554337 0.90 AGTR1 (0.34) AGTR1AGTR2PPARG
SCHEMBL9532527 0.90 AGTR1 (0.38) AGTR1AGTR2
SCHEMBL9534365 0.89 AGTR1 (0.40) AGTR1AGTR2PPARG
SCHEMBL9553782 0.89 AGTR1 (0.40) AGTR1AGTR2PPARG

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