SCHEMBL5554541

SCHEMBL5554541

CCOC(Cc1ccnc(OCCOc2ccccc2)c1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 19/20 0.61
PPARG P37231 16/20 0.61
PPARD Q03181 7/20 0.61

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
SCHEMBL5550680 0.90 PPARA (0.56) PPARAPPARGPPARD
SCHEMBL5555664 0.89 PPARA (0.53) PPARAPPARGPPARD
SCHEMBL5550678 0.88 PPARA (0.53) PPARAPPARGPPARD
SCHEMBL5554502 0.87 PPARA (0.53) PPARAPPARGPPARD
SCHEMBL5551032 0.86 PPARG (0.49) PPARAPPARGPPARD
SCHEMBL5550981 0.85 PPARG (0.48) PPARAPPARGPPARD
SCHEMBL6847766 0.84 PPARA (0.48) PPARAPPARGPPARD
SCHEMBL5554510 0.81 PPARA (0.47) PPARAPPARGPPARD
SCHEMBL5387695 0.79 PPARA (0.93) PPARAPPARGPPARD
SCHEMBL5382863 0.79 PPARA (0.93) PPARAPPARGPPARD

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