SCHEMBL8364418

SCHEMBL8364418

Cc1ccc(C(=O)O)c2c1nc(C1CC1)n2-c1ccc(-c2ccccc2-c2nc(=O)s[nH]2)cc1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.44
AGTR2 P50052 2/20 0.44
PPARG P37231 1/20 0.32
DHODH Q02127 3/20 0.32

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
SCHEMBL8363471 0.85 AGTR1 (0.44) AGTR1AGTR2PPARGDHODH
SCHEMBL8359912 0.83 AGTR1 (0.44) AGTR1AGTR2DHODH
SCHEMBL8359332 0.81 ALDH1A1 (0.38) PPARG
SCHEMBL8356866 0.78 AGTR1 (0.34) AGTR1AGTR2PPARG
SCHEMBL8361950 0.77 AGTR1 (0.38) AGTR1AGTR2PPARG
SCHEMBL8357459 0.76 AGTR2 (0.36) AGTR2PPARG
SCHEMBL8364583 0.75 AGTR1 (0.37) AGTR1AGTR2PPARG
SCHEMBL7016811 0.73 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL8364430 0.73 PPARG (0.38) AGTR1AGTR2PPARG
SCHEMBL7016748 0.73 AGTR1 (0.47) 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-5883111-A STRONG AND LONG-LASTING ACTION BY ORAL ADMINISTRATION; HYPOTENSIVE AGENTS; CARDIOTONIC AGENTS; ALZHEIMER'S DISEASE; TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-03-16 US disclosed
US-5736555-A HYPOTENSIVE AGENTS; FDA ORANGE BOOK LISTED PATENT FOR AZILSARTAN MEDOXOMIL TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-04-07 US disclosed