SCHEMBL4645048

SCHEMBL4645048

O=C(Cc1ccccc1-c1ccccc1)NCCCOc1ccc(CC(Nc2ccccc2C(=O)c2ccccc2)C(=O)O)cc1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.63
PPARA Q07869 1/20 0.60

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
SCHEMBL4643356 0.97 PPARG (0.64) PPARGPPARA
SCHEMBL4647580 0.93 PPARG (0.57) PPARGPPARA
SCHEMBL4682497 0.91 PPARG (0.67) PPARGPPARA
SCHEMBL4645631 0.90 PPARG (0.57) PPARGPPARA
SCHEMBL4643051 0.88 PPARG (0.68) PPARGPPARA
SCHEMBL4647733 0.87 PPARG (0.60) PPARGPPARA
SCHEMBL4684897 0.85 PPARG (0.67) PPARGPPARA
SCHEMBL4684889 0.85 PPARG (0.67) PPARGPPARA
SCHEMBL4646568 0.85 PPARG (0.66) PPARGPPARA
SCHEMBL4646545 0.84 PPARG (0.61) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778624-B1 TYROSINE DERIVATIVES AS PPAR-GAMMA-MODULATORS SALVAT LAB SA (ES) 2008-08-20 EP disclosed