SCHEMBL16609828

SCHEMBL16609828

COC(=O)CC1COc2cc(C)ccc21

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 16/20 0.55
PPARD Q03181 8/20 0.55
PPARG P37231 7/20 0.55
USP2 O75604 1/20 0.44
GAA P10253 1/20 0.44
PPARA Q07869 1/20 0.43

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
SCHEMBL15292395 1.00 FFAR1 (0.55) FFAR1PPARDPPARGUSP2GAA
SCHEMBL18512247 1.00 FFAR1 (0.55) FFAR1PPARDPPARGUSP2GAA
SCHEMBL9275740 0.86 FFAR1 (0.53) FFAR1PPARDPPARGPPARA
SCHEMBL435248 0.86 FFAR1 (0.53) FFAR1PPARDPPARGPPARA
SCHEMBL9277990 0.86 FFAR1 (0.53) FFAR1PPARDPPARGPPARA
SCHEMBL2691621 0.85 PPARD (0.54) FFAR1PPARDPPARGPPARA
SCHEMBL13311839 0.85 FFAR1 (0.46) FFAR1PPARDPPARGPPARA
SCHEMBL15292428 0.84 FFAR1 (0.69) FFAR1PPARDPPARGPPARA
SCHEMBL15299338 0.84 FFAR1 (0.69) FFAR1PPARDPPARGPPARA
SCHEMBL21979154 0.81 PPARG (0.49) FFAR1PPARDPPARGGAAPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2831053-B1 NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACID DERIVATIVES AND THEIR USE AS GPR40 RECEPTOR AGONISTS BOEHRINGER INGELHEIM INT (DE) 2016-06-22 EP disclosed
WO-2015044073-A1 PROCESS AND INTERMEDIATES FOR PREPARING INDANYLOXYDIHYDROBENZOFURANYL ACETIC ACID DERIVATIVES AS GPR40 AGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-04-02 WO disclosed