SCHEMBL9979508

SCHEMBL9979508

CCOC(=O)Cn1ccc2cc(OCCOc3cccc4c3CN(c3ccc(OC(F)(F)F)cc3)C4=O)ccc21

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 12/20 0.38
PPARG P37231 12/20 0.38
PPARA Q07869 11/20 0.38
NR5A1 Q13285 1/20 0.37
UGCG Q16739 3/20 0.36
MAPT P10636 1/20 0.34

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
SCHEMBL9979654 0.98 PPARG (0.40) PPARDPPARGPPARANR5A1UGCG
SCHEMBL9979468 0.93 PPARD (0.45) PPARDPPARGPPARAUGCG
SCHEMBL9979611 0.90 PPARD (0.46) PPARDPPARGPPARA
SCHEMBL9979701 0.88 PPARG (0.49) PPARDPPARGPPARA
SCHEMBL9979472 0.85 GCGR (0.34) PPARDPPARGPPARANR5A1UGCG
SCHEMBL9979504 0.82 PPARD (0.56) PPARDPPARGPPARAUGCG
SCHEMBL9979610 0.81 PPARD (0.54) PPARDPPARGPPARAUGCG
SCHEMBL9979687 0.80 PPARD (0.56) PPARDPPARGPPARA
SCHEMBL9979476 0.79 PPARD (0.50) PPARDPPARGPPARA
SCHEMBL9979487 0.77 PPARD (0.53) PPARDPPARGPPARA

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
WO-2012081570-A1 LACTAM COMPOUND OR A SALT THEREOF, AND PPAR ACTIVATOR あすか製薬株式会社 (JP) 2012-06-21 WO disclosed