SCHEMBL4643020

SCHEMBL4643020

CC(C)(C)CC(=O)c1ccccc1NCCOc1ccc(CC(Nc2ccccc2C(=O)c2ccccc2)C(=O)O)cc1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.68
PPARA Q07869 1/20 0.62

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
SCHEMBL4646793 0.97 PPARG (0.67) PPARGPPARA
SCHEMBL4643170 0.91 PPARG (0.77) PPARGPPARA
SCHEMBL4645403 0.89 PPARG (0.70) PPARGPPARA
SCHEMBL4646069 0.88 PPARG (0.76) PPARGPPARA
SCHEMBL4643291 0.87 PPARG (0.67) PPARGPPARA
SCHEMBL4645380 0.86 PPARG (0.71) PPARGPPARA
SCHEMBL4684695 0.86 PPARG (0.68) PPARGPPARA
SCHEMBL4645212 0.86 PPARG (0.69) PPARGPPARA
SCHEMBL4645582 0.85 PPARG (0.65) PPARGPPARA
SCHEMBL4647451 0.85 PPARG (0.65) 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