SCHEMBL4347902

SCHEMBL4347902

CC(C)(C)[Si](C)(C)Oc1cccc(CCOc2ccc(CCC(=O)O)cc2)c1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 16/20 0.63
FFAR4 Q5NUL3 5/20 0.52
LMNA P02545 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
PPARG P37231 2/20 0.47
PPARD Q03181 1/20 0.47
PPARA Q07869 1/20 0.47
AKR1B1 P15121 1/20 0.47
CYP4F2 P78329 1/20 0.46
CYP4A11 Q02928 1/20 0.46

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
SCHEMBL2890795 0.87 FFAR1 (0.47) FFAR1PPARGPPARACYP4F2CYP4A11
SCHEMBL4266308 0.82 FFAR1 (0.53) FFAR1FFAR4LMNAL3MBTL1
SCHEMBL4548366 0.81 CA12 (0.49) FFAR1FFAR4LMNAL3MBTL1
SCHEMBL3235704 0.78 CYP1A2 (0.49) FFAR1PPARDAKR1B1CYP4F2CYP4A11
SCHEMBL8008498 0.78 RAB9A (0.50) PPARGPPARA
SCHEMBL1745370 0.78 FFAR1 (1.00) FFAR1FFAR4LMNAL3MBTL1AKR1B1
SCHEMBL27721793 0.77 PPARA (0.39) PPARGPPARACYP4F2CYP4A11
SCHEMBL1746780 0.77 FFAR1 (1.00) FFAR1FFAR4AKR1B1
SCHEMBL6171029 0.75 HDAC1 (0.41) PPARGPPARA
SCHEMBL8413352 0.75 SIGMAR1 (0.44) PPARGPPARACYP4F2CYP4A11

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2098517-A1 NOVEL PHENYL-ISOXAZOL-3-OL DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-09-09 EP disclosed