SCHEMBL8537167

SCHEMBL8537167

CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)NCc1ccc(NC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 7/20 0.51
CNR1 P21554 5/20 0.49
FAAH O00519 4/20 0.49
CNR2 P34972 3/20 0.49
SOAT1 P35610 1/20 0.49
ALOX12 P18054 1/20 0.43
ALDH1A1 P00352 2/20 0.41

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
SCHEMBL8532499 0.94 EPHX2 (0.60) EPHX2CNR1FAAHCNR2SOAT1
SCHEMBL8537601 0.92 SOAT1 (0.52) EPHX2CNR1FAAHCNR2SOAT1
SCHEMBL8537603 0.92 SOAT1 (0.52) EPHX2CNR1FAAHCNR2SOAT1
SCHEMBL8533581 0.86 SOAT1 (0.61) EPHX2CNR1FAAHCNR2SOAT1
SCHEMBL8533580 0.86 SOAT1 (0.61) EPHX2CNR1FAAHCNR2SOAT1
SCHEMBL8532492 0.83 SOAT1 (0.55) EPHX2CNR1FAAHCNR2SOAT1
SCHEMBL8532494 0.83 SOAT1 (0.55) EPHX2CNR1FAAHCNR2SOAT1
SCHEMBL8533117 0.81 SOAT1 (0.70) EPHX2CNR1FAAHSOAT1ALDH1A1
SCHEMBL8533118 0.81 SOAT1 (0.70) EPHX2CNR1FAAHSOAT1ALDH1A1
SCHEMBL8537165 0.80 SOAT1 (0.47) SOAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5801178-A ACAT INHIBITOR, ARTERIOSCLEROSIS NIPPON SHOJI KAISH LTD. (JP) 1998-09-01 US disclosed
EP-0726247-B1 Aniline derivatives having a polyunsaturated fatty acid residue and use thereof NIPPON SHOJI KAISHA LTD (JP) 1998-07-08 EP disclosed
EP-0726247-A1 Aniline derivatives having a polyunsaturated fatty acid residue and use thereof NIPPON SHOJI KAISHA, LIMITED (JP) 1996-08-14 EP disclosed