SCHEMBL7524716

SCHEMBL7524716

CCCCCCCCCCCCCCCC(=O)OCC(C)(C)NC(=O)c1ccc(F)cc1F

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
HDAC3 O15379 1/20 0.41
GAA P10253 1/20 0.39
DGKA P23743 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
SOAT1 P35610 1/20 0.36
EPHX2 P34913 1/20 0.36
RARB P10826 2/20 0.36
RARA P10276 1/20 0.36
RARG P13631 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35

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
SCHEMBL7534518 1.00 CNR1 (0.42) CNR1CNR2HDAC3GAADGKA
SCHEMBL7525136 1.00 CNR1 (0.42) CNR1CNR2HDAC3GAADGKA
SCHEMBL7529343 1.00 CNR1 (0.42) CNR1CNR2HDAC3GAADGKA
SCHEMBL7527977 0.95 CNR1 (0.41) CNR1CNR2HDAC3SMN1; SMN2NPSR1
SCHEMBL7522596 0.91 F2R (0.39) CNR1CNR2HDAC3NPSR1L3MBTL1
SCHEMBL7523804 0.86 HDAC3 (0.41) CNR1CNR2HDAC3GAAL3MBTL1
SCHEMBL7528950 0.86 L3MBTL1 (0.42) CNR1CNR2GAASMN1; SMN2NPSR1
SCHEMBL7522572 0.85 LMNA (0.39) CNR1CNR2HDAC3NPSR1L3MBTL1
SCHEMBL7527980 0.83 CNR1 (0.44) CNR1CNR2RARBRARANPSR1
SCHEMBL7525193 0.82 CES2 (0.40) CNR1CNR2HDAC3GAASMN1; SMN2

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-1184367-A1 AMIDE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2002-03-06 EP disclosed