SCHEMBL9498652

SCHEMBL9498652

CCCCCCCCCCCCCCCCCC(=O)Nc1c(OC)cc(OC)cc1OC

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.64
TP53 P04637 1/20 0.64
CYP3A4 P08684 1/20 0.64
MAPT P10636 1/20 0.64
ALOX15 P16050 1/20 0.64
TSHR P16473 1/20 0.64
ACAT1 P24752 1/20 0.64
SOAT1 P35610 1/20 0.64
GAA P10253 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
CNR1 P21554 2/20 0.53
EPHX2 P34913 1/20 0.51

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
SCHEMBL9497942 1.00 KDM4E (0.64) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL9499542 1.00 KDM4E (0.64) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL9498007 1.00 KDM4E (0.64) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL10683818 0.94 MAPT (0.59) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL9446331 0.92 CNR1 (0.66) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL9498564 0.92 CNR1 (0.66) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL9498071 0.92 CNR1 (0.66) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL9498573 0.92 CNR1 (0.66) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL9446334 0.92 CNR1 (0.66) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL9316354 0.90 KDM4E (0.60) KDM4ETP53CYP3A4MAPTALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0283742-B1 FATTY ACID AMIDES AS INHIBITORS OF ACYL-COA: CHOLESTEROL ACYLTRANSFERASE WARNER-LAMBERT COMPANY (US) 1993-05-26 EP claimed
EP-0283742-A2 Fatty acid amides as inhibitors of acyl-CoA: cholesterol acyltransferase WARNER-LAMBERT COMPANY (US) 1988-09-28 EP claimed
EP-0283742-B1 FATTY ACID AMIDES AS INHIBITORS OF ACYL-COA: CHOLESTEROL ACYLTRANSFERASE WARNER-LAMBERT COMPANY (US) 1993-05-26 EP disclosed
US-4859703-A Lipid regulating compositions WARNER-LAMBERT COMPANY (US) 1989-08-22 US disclosed
EP-0283742-A2 Fatty acid amides as inhibitors of acyl-CoA: cholesterol acyltransferase WARNER-LAMBERT COMPANY (US) 1988-09-28 EP disclosed
US-4751026-A INHIBITING INTESTINAL ABSORPTION OF CHOLESTEROL WARNER-LAMBERT COMPANY (US) 1988-06-14 US disclosed
EP-0242610-A1 Substituted anilides of oleic, linoleic or linolenic acid as inhibitors of acyl-coa: cholesterol acyltransferase WARNER-LAMBERT COMPANY (US) 1987-10-28 EP disclosed