SCHEMBL9873967

SCHEMBL9873967

CCCCCCCCC=CCCCCCCCC(=O)Nc1nc(OC)cc(OC)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 7/20 0.59
SOAT2 O75908 1/20 0.54
SOAT1 P35610 1/20 0.54
PSMB11 A5LHX3 1/20 0.53
PSMA7 O14818 1/20 0.53
PSMB1 P20618 1/20 0.53
PSMA1 P25786 1/20 0.53
PSMA2 P25787 1/20 0.53
PSMA3 P25788 1/20 0.53
PSMA4 P25789 1/20 0.53
PSMB8 P28062 1/20 0.53
PSMB9 P28065 1/20 0.53
PSMA5 P28066 1/20 0.53
PSMB4 P28070 1/20 0.53
PSMB6 P28072 1/20 0.53
PSMB5 P28074 1/20 0.53
PSMB10 P40306 1/20 0.53
PSMB3 P49720 1/20 0.53
PSMB2 P49721 1/20 0.53
PSMA6 P60900 1/20 0.53

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
SCHEMBL9873961 1.00 CNR1 (0.59) CNR1SOAT2SOAT1PSMB11PSMA7
SCHEMBL9874778 0.89 SOAT2 (0.53) CNR1SOAT2SOAT1PSMB11PSMA7
SCHEMBL9874136 0.89 SOAT2 (0.53) CNR1SOAT2SOAT1PSMB11PSMA7
SCHEMBL9873777 0.89 SOAT2 (0.53) CNR1SOAT2SOAT1PSMB11PSMA7
SCHEMBL1152329 0.79 SOAT1 (0.56) CNR1SOAT2SOAT1PSMB11PSMA7
SCHEMBL17612180 0.79 SOAT1 (0.56) CNR1SOAT2SOAT1PSMB11PSMA7
SCHEMBL28757288 0.79 SOAT1 (0.56) CNR1SOAT2SOAT1PSMB11PSMA7
SCHEMBL10491566 0.78 SOAT1 (0.54) CNR1SOAT2SOAT1PSMB11PSMA7
Potassium SCHEMBL31403449 0.78 SOAT1 (0.54) CNR1SOAT2SOAT1PSMB11PSMA7
SCHEMBL8993787 0.78 SOAT2 (0.64) CNR1SOAT2SOAT1PSMB11PSMA7

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
EP-0245687-B1 SUBSTITUTED PYRIMIDINE AMIDES OF OLEIC OR LINOLEIC ACID AS INHIBITORS OF ACYL-COA CHOLESTEROL ACYLTRANSFERASE WARNER-LAMBERT COMPANY (US) 1991-02-27 EP claimed
US-4722927-A ANTICHOLESTEROL AGENTS WARNER-LAMBERT COMPANY (US) 1988-02-02 US claimed
EP-0245687-A1 Substituted pyrimidine amides of oleic or linoleic acid as inhibitors of acyl-coa cholesterol acyltransferase WARNER-LAMBERT COMPANY (US) 1987-11-19 EP claimed