SCHEMBL9498087

SCHEMBL9498087

CCCCCCCCCCCCC(C)C(=O)Nc1c(OC)cc(OC)cc1OC

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.58
TP53 P04637 1/20 0.58
CYP3A4 P08684 1/20 0.58
MAPT P10636 1/20 0.58
ALOX15 P16050 1/20 0.58
TSHR P16473 1/20 0.58
ACAT1 P24752 1/20 0.58
SOAT1 P35610 1/20 0.58

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
SCHEMBL9498075 1.00 KDM4E (0.58) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL9498134 0.93 KDM4E (0.52) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL9498121 0.93 KDM4E (0.52) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL8856463 0.88 KDM4E (0.63) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL8856673 0.86 KDM4E (0.57) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL9497880 0.86 KDM4E (0.60) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL8856261 0.82 KDM4E (0.53) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL13771852 0.81 KDM4E (0.68) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL9838111 0.81 KDM4E (0.52) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL8856233 0.79 KDM4E (0.50) 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 4 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
US-4716175-A INHIBITION OF INTESTINAL ABSORPTION OF CHOLESTEROL WARNER-LAMBERT COMPANY (US) 1987-12-29 US claimed
US-4743605-A PREVENT ABSORPTION OF CHOLESTEROL WARNER-LAMBERT COMPANY (US) 1988-05-10 US disclosed
US-4716175-A INHIBITION OF INTESTINAL ABSORPTION OF CHOLESTEROL WARNER-LAMBERT COMPANY (US) 1987-12-29 US disclosed