SCHEMBL8359332

SCHEMBL8359332

CCCCOc1nc2c(C)ccc(C(=O)O)c2n1-c1ccc(-c2ccccc2-c2nc(=O)s[nH]2)cc1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
NPY1R P25929 1/20 0.38
NPY2R P49146 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PPARG P37231 1/20 0.34

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
SCHEMBL8357459 0.85 AGTR2 (0.36) LMNAPPARG
SCHEMBL8361975 0.85 ALDH1A1 (0.36) ALDH1A1LMNANPY1RNPY2RL3MBTL1
SCHEMBL8364418 0.81 AGTR1 (0.44) PPARG
SCHEMBL8419023 0.80 ALDH1A1 (0.36) ALDH1A1PPARG
SCHEMBL8364583 0.80 AGTR1 (0.37) PPARG
SCHEMBL8359530 0.79 AGTR1 (0.39) PPARG
SCHEMBL8364430 0.79 PPARG (0.38) PPARG
SCHEMBL8417384 0.77 PLA2G2A (0.36)
SCHEMBL8711109 0.77 AGTR2 (0.47) PPARG
SCHEMBL8421698 0.77 AGTR1 (0.41) PPARG

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