SCHEMBL1400548

SCHEMBL1400548

CCC(C(=O)O)[C@@H]1CCc2cc(OCCCNc3ccc(C(F)(F)F)c(Cl)n3)ccc21

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.56
PPARG P37231 17/20 0.54

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
SCHEMBL1400388 0.88 PPARA (0.56) PPARAPPARG
SCHEMBL1401034 0.87 PPARA (0.57) PPARAPPARG
SCHEMBL3013446 0.83 PPARD (0.60) PPARA
SCHEMBL1400701 0.81 PPARA (0.57) PPARAPPARG
SCHEMBL12798880 0.81 PPARD (0.47) PPARAPPARG
SCHEMBL1400265 0.81 PPARA (0.58) PPARAPPARG
SCHEMBL1400563 0.81 PPARG (0.61) PPARAPPARG
SCHEMBL1400625 0.79 PPARA (0.56) PPARAPPARG
SCHEMBL1400195 0.78 PPARG (0.53) PPARAPPARG
SCHEMBL1400965 0.78 PPARG (0.56) PPARAPPARG

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-1578715-B1 INDANE ACETIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS, INTERMEDIATES, AND METHOD OF PREPARATION BAYER PHARMACEUTICALS CORP (US) 2011-03-02 EP disclosed