SCHEMBL29930451

SCHEMBL29930451

O=C(c1ccc(F)cc1)c1ccccc1NC(Cc1ccc(OCCc2cccc3c2[nH]c2ccccc23)cc1)C(=O)O.[Na]

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.63
PPARA Q07869 3/20 0.55

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
SCHEMBL29930321 0.99 PPARG (0.64) PPARGPPARA
SCHEMBL1720328 0.99 PPARG (0.64) PPARGPPARA
SCHEMBL28494551 0.98 PPARG (0.63) PPARGPPARA
SCHEMBL1719558 0.95 PPARG (0.70) PPARGPPARA
Tetrahydrofuran SCHEMBL28503087 0.94 PPARG (0.58) PPARGPPARA
SCHEMBL1720775 0.93 PPARG (0.67) PPARGPPARA
SCHEMBL29930546 0.92 PPARG (0.54) PPARGPPARA
SCHEMBL1721006 0.91 PPARG (0.62) PPARGPPARA
SCHEMBL5065101 0.88 PPARG (0.67) PPARGPPARA
SCHEMBL1720151 0.88 PPARG (0.61) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112479977-B Substituted phenylpropionic acid compound enantiomer, and preparation method, composition and application thereof 深圳微芯生物科技股份有限公司 2022-07-19 CN disclosed