SCHEMBL4644697

SCHEMBL4644697

COC(=O)[C@H](Cc1ccc(OCCCNC(=O)CCc2ccc(Cl)cc2)cc1)Nc1ccccc1C(=O)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.67
PPARA Q07869 1/20 0.53
KMT2A Q03164 1/20 0.53
ATM Q13315 1/20 0.53

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
SCHEMBL4643064 0.98 PPARG (0.68) PPARGPPARAKMT2AATM
SCHEMBL4648057 0.95 PPARG (0.65) PPARGPPARA
SCHEMBL4648481 0.93 PPARG (0.62) PPARGPPARA
SCHEMBL4736207 0.93 PPARG (0.79) PPARGPPARA
SCHEMBL4736212 0.93 PPARG (0.79) PPARGPPARA
SCHEMBL4643444 0.93 PPARG (0.64) PPARGPPARA
SCHEMBL4645366 0.93 PPARG (0.64) PPARGPPARA
SCHEMBL4646339 0.92 PPARG (0.57) PPARGPPARA
SCHEMBL4644893 0.91 PPARG (0.57) PPARGPPARA
SCHEMBL4646186 0.90 PPARG (0.66) 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