SCHEMBL5550668

SCHEMBL5550668

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

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.52
PPARA Q07869 16/20 0.52
NPC1 O15118 1/20 0.51
MITF O75030 1/20 0.51
LMNA P02545 1/20 0.51
TP53 P04637 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
PPARD Q03181 2/20 0.50
MCL1 Q07820 1/20 0.48

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
SCHEMBL5556307 0.91 PPARG (0.57) PPARGPPARAPPARD
SCHEMBL14437956 0.89 PPARA (0.58) PPARGPPARAPPARD
SCHEMBL5556293 0.88 NPC1 (0.51) PPARGPPARANPC1MITFLMNA
SCHEMBL5551023 0.88 PPARA (0.55) PPARGPPARAPPARD
SCHEMBL5554508 0.87 PPARG (0.52) PPARGPPARAPPARD
SCHEMBL5555653 0.83 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL5555638 0.82 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL5550996 0.80 PPARG (0.49) PPARGPPARANPC1MITFLMNA
SCHEMBL4343436 0.79 PPARA (0.58) PPARGPPARAPPARD
SCHEMBL5554523 0.78 PPARA (0.47) PPARGPPARANPC1RAB9ASMN1; SMN2

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