SCHEMBL3454545

SCHEMBL3454545

Cc1nc(-c2c(OCCC3CC3)cc[nH]c2=O)sc1C(=O)NCc1ccc(F)cc1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCD O00767 7/20 0.49
PPARA Q07869 11/20 0.49
PPARD Q03181 5/20 0.41
PPARG P37231 2/20 0.40

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
SCHEMBL3478653 0.92 SCD (0.59) SCD
SCHEMBL3454672 0.87 SCD (0.53) SCD
SCHEMBL3456448 0.84 SCD (0.51) SCDPPARAPPARD
SCHEMBL3455023 0.84 SCD (0.51) SCDPPARAPPARD
SCHEMBL3454095 0.83 SCD (0.50) SCD
SCHEMBL3454091 0.83 SCD (0.40) SCDPPARAPPARD
SCHEMBL3454615 0.81 PPARA (0.49) SCDPPARAPPARDPPARG
SCHEMBL3454598 0.81 SCD (0.56) SCDPPARAPPARD
SCHEMBL3455505 0.80 SCD (0.48) SCD
SCHEMBL3454105 0.80 LMNA (0.44) SCD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007143597-A9 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-11-11 WO claimed
WO-2007143597-A9 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-11-11 WO disclosed