SCHEMBL6950862

SCHEMBL6950862

CCOC(Cc1ccc(CCCn2ccc3ccccc3c2=O)cc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.55
PPARG P37231 17/20 0.51
PPARA Q07869 17/20 0.51
PPARD Q03181 5/20 0.50

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
SCHEMBL6955219 0.83 PPARA (0.50) PPARGPPARAPPARD
SCHEMBL7852911 0.79 PPARA (0.72) PPARGPPARAPPARD
SCHEMBL7532542 0.79 PPARA (0.72) PPARGPPARAPPARD
SCHEMBL7535616 0.79 PPARA (0.66) PPARGPPARAPPARD
SCHEMBL6948727 0.77 PPARG (0.56) TNFPPARGPPARAPPARD
SCHEMBL6956586 0.77 ALDH1A1 (0.50) PPARGPPARAPPARD
SCHEMBL6954944 0.77 PPARA (0.50) PPARGPPARAPPARD
SCHEMBL7527048 0.75 PPARA (0.74) PPARGPPARAPPARD
SCHEMBL6956762 0.75 TNF (0.50) TNFPPARGPPARA
SCHEMBL5658926 0.75 PPARG (0.48) PPARGPPARAPPARD

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
EP-0903343-B1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP CO LTD (JP) 2003-05-28 EP disclosed
EP-0903343-A1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP Co., Ltd. (JP) 1999-03-24 EP disclosed