SCHEMBL8323159

SCHEMBL8323159

CCCCCCCC(Sc1ccc(CCC)cc1)C(=O)Nc1c(OC)cc(OC)cc1OC

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
MAPT P10636 1/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
ACAT1 P24752 1/20 0.47
SOAT1 P35610 1/20 0.47
MMP9 P14780 1/20 0.46
MMP13 P45452 1/20 0.46
ADAM17 P78536 1/20 0.46

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
SCHEMBL8856313 0.96 KDM4E (0.47) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL8856229 0.87 KDM4E (0.51) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL8856207 0.87 KDM4E (0.51) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL8856098 0.85 KDM4E (0.49) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL8856121 0.82 KDM4E (0.51) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL8856332 0.81 MMP9 (0.44) MMP9MMP13ADAM17
SCHEMBL8856261 0.80 KDM4E (0.53) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL8856859 0.78
SCHEMBL8856362 0.77 MMP9 (0.44) MMP9MMP13ADAM17
SCHEMBL8856463 0.77 KDM4E (0.63) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0609960-B1 New N-heteroarylamide derivatives as inhibitors of acyl coenzyme A: cholestrol acyl transferase PFIZER (US) 1999-03-03 EP disclosed
US-5656634-A N-aryl and N-heteroarylamide and urea derivatives as inhibitors of acyl coenzyme A: cholesterol acyl transferase (ACAT) PFIZER INC. (US) 1997-08-12 US disclosed
EP-0418071-B1 New N-aryl and N-heteroarylamide and urea derivatives as inhibitors of acyl coenzyme A: cholesterol acyl transferase PFIZER (US) 1995-04-26 EP disclosed
US-5362878-A Intermediates for making N-aryl and N-heteroarylamide and urea derivatives as inhibitors of acyl coenzyme A: cholesterol acyl transferase (ACAT) PFIZER INC. (US) 1994-11-08 US disclosed
EP-0609960-A1 New N-heteroarylamide derivatives as inhibitors of acyl coenzyme A: cholestrol acyl transferase PFIZER INC. (US) 1994-08-10 EP disclosed
WO-1991004027-A1 NEW N-ARYL AND N-HETEROARYLAMIDE AND UREA DERIVATIVES AS INHIBITORS OF ACYL COENZYME A: CHOLESTEROL ACYL TRANSFERASE (ACAT) PFIZER INC. (US) 1991-04-04 WO disclosed