SCHEMBL3455616

SCHEMBL3455616

Cc1nc(-c2cc(OCc3ccccc3)c[nH]c2=O)sc1C(=O)NCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCD O00767 13/20 0.57
PPARD Q03181 1/20 0.49
PPARA Q07869 1/20 0.49
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
NPC1 O15118 1/20 0.46
HPGD P15428 1/20 0.46

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
SCHEMBL3454783 0.85 SCD (0.56) SCDPPARDPPARANPC1HPGD
SCHEMBL3454850 0.84 SCD (0.56) SCDPPARDPPARAMEN1KMT2A
SCHEMBL3454540 0.82 SCD (0.57) SCDPPARDPPARA
SCHEMBL3454804 0.82 SCD (0.56) SCDPPARDPPARANPC1HPGD
SCHEMBL3455677 0.80 SCD (0.60) SCDPPARDPPARANPC1HPGD
SCHEMBL3455858 0.79 SCD (0.54) SCDNPC1HPGD
SCHEMBL3454303 0.78 SCD (0.61) SCDNPC1HPGD
SCHEMBL3454282 0.77 SCD (0.54) SCD
SCHEMBL3456450 0.77 SCD (0.55) SCDPPARDPPARANPC1HPGD
SCHEMBL3454098 0.77 SCD (0.58) SCDPPARDPPARANPC1HPGD

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