SCHEMBL8364430

SCHEMBL8364430

CCCCc1nc2c(C)ccc(C(=O)O)c2n1-c1ccc(-c2ccccc2-c2nc(=S)s[nH]2)cc1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.38
AGTR2 P50052 2/20 0.38
AGTR1 P30556 1/20 0.38

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
SCHEMBL8362097 0.86 PPARG (0.39) PPARGAGTR2
SCHEMBL8362076 0.84 AGTR2 (0.40) PPARGAGTR2AGTR1
SCHEMBL8364392 0.80 AGTR2 (0.44) AGTR2AGTR1
SCHEMBL8359332 0.79 ALDH1A1 (0.38) PPARG
SCHEMBL8359678 0.78 PPARG (0.39) PPARGAGTR2AGTR1
SCHEMBL8364583 0.78 AGTR1 (0.37) PPARGAGTR2AGTR1
SCHEMBL7020231 0.76 AGTR2 (0.60) PPARGAGTR2AGTR1
SCHEMBL8587855 0.75 PPARG (0.38) PPARG
SCHEMBL8361975 0.75 ALDH1A1 (0.36) PPARG
SCHEMBL7009917 0.75 AGTR2 (0.47) AGTR2AGTR1

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