SCHEMBL5550667

SCHEMBL5550667

CC(C)OC(Cc1ccnc(OCCOc2ccc(C(C)(C)C)cc2)c1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.52
PPARA Q07869 17/20 0.52
PPARD Q03181 10/20 0.52
KMT2A Q03164 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MITF O75030 1/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL5551008 0.91 PPARG (0.53) PPARGPPARAPPARD
SCHEMBL5551032 0.88 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL5550678 0.88 PPARA (0.53) PPARGPPARAPPARD
SCHEMBL5550989 0.87 PPARA (0.55) PPARGPPARAPPARD
SCHEMBL5556283 0.87 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL4335117 0.84 PPARG (0.52) PPARGPPARAPPARDKMT2AKDM4E
SCHEMBL5550663 0.82 PPARG (0.50) PPARGPPARAPPARD
SCHEMBL5556259 0.81 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL4341834 0.80 PPARA (0.53) PPARGPPARAPPARD
SCHEMBL5554502 0.78 PPARA (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