SCHEMBL16348352

SCHEMBL16348352

CCn1ccc(-c2cc(Cl)ccc2OC(C(=O)O)c2cccc(C(F)(F)F)c2)n1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.48
PPARA Q07869 2/20 0.43
SLC6A4 P31645 6/20 0.39
HTT P42858 1/20 0.38
SLC22A12 Q96S37 1/20 0.38
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
HTR6 P50406 1/20 0.37

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
SCHEMBL16348313 0.92 PPARG (0.44) PPARGPPARASLC6A4SLC22A12HTR2C
SCHEMBL16348326 0.91 PPARG (0.41) PPARGSLC6A4HTTSLC22A12HTR2C
SCHEMBL16348427 0.90 PPARG (0.39) PPARGPPARASLC6A4HTTHTR2C
SCHEMBL16348327 0.90 PPARA (0.46) PPARGPPARA
SCHEMBL16348309 0.89 PPARA (0.52) PPARGPPARA
SCHEMBL16348312 0.87 PPARA (0.43) PPARGPPARA
SCHEMBL16348306 0.86 PPARG (0.51) PPARGPPARA
SCHEMBL16348368 0.84 PPARG (0.38) PPARGSLC6A4SLC22A12HTR2CHTR2B
SCHEMBL16348351 0.83 PPARG (0.47) PPARGPPARASLC6A4HTTSLC22A12
SCHEMBL16348363 0.82 PPARG (0.52) PPARGPPARA

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
US-7642358-B2 Substituted phenylacetic acids METABOLEX, INC. (US) 2010-01-05 US disclosed
US-7642358-B2 Substituted phenylacetic acids METABOLEX, INC. (US) 2010-01-05 US disclosed