SCHEMBL5555653

SCHEMBL5555653

CCOC(Cc1ccn(CCOc2ccc(C3CCCC3)cc2)c(=O)c1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.49
PPARA Q07869 18/20 0.48
PPARD Q03181 3/20 0.47

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
SCHEMBL5555638 0.99 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL5556228 0.89 PPARG (0.46) PPARGPPARAPPARD
SCHEMBL5551017 0.88 PPARG (0.47) PPARGPPARAPPARD
SCHEMBL14437956 0.85 PPARA (0.58) PPARGPPARAPPARD
SCHEMBL5551023 0.85 PPARA (0.55) PPARGPPARAPPARD
SCHEMBL5554508 0.84 PPARG (0.52) PPARGPPARAPPARD
SCHEMBL5550668 0.83 PPARG (0.52) PPARGPPARAPPARD
SCHEMBL5556307 0.82 PPARG (0.57) PPARGPPARAPPARD
SCHEMBL4335092 0.81 PPARG (0.54) PPARGPPARAPPARD
SCHEMBL4332364 0.80 PPARG (0.53) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7253178-B2 Carboxylic acids EISAI CO., LTD. (JP) 2007-08-07 US disclosed
US-7253178-B2 Carboxylic acids EISAI CO., LTD. (JP) 2007-08-07 US disclosed
US-7253178-B2 Carboxylic acids EISAI CO., LTD. (JP) 2007-08-07 US disclosed
US-20040116708-A1 Insulin sensitizers; antidiabetic agents, antiinflammatory agents; inflammatory bowel disorders EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-06-17 US disclosed
EP-1375484-A1 CARBOXYLIC ACIDS Eisai Co., Ltd. (JP) 2004-01-02 EP disclosed