SCHEMBL8856877

SCHEMBL8856877

CCCCCCCCC(SCCCCCC)C(=O)Nc1c(OC)ccc2ncccc12

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.38
ATM Q13315 1/20 0.38
ALOX5 P09917 5/20 0.38
PTGES O14684 1/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 1/20 0.36
GLA P06280 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL8856308 0.93 ALOX5 (0.40) TRPV1ALOX5PTGESPPARGPPARA
SCHEMBL8856150 0.87 ALDH1A1 (0.44) TRPV1ALOX5PTGESPPARGPPARA
SCHEMBL8856370 0.87 TRPV1 (0.39) TRPV1ALOX5PTGESPPARGPPARA
SCHEMBL8856345 0.87 TRPV1 (0.39) TRPV1ALOX5PTGESPPARGPPARA
SCHEMBL8856365 0.87 ALOX5 (0.42) TRPV1ALOX5PTGESPPARGPPARA
SCHEMBL8856096 0.86 TRPV1 (0.42) TRPV1ATMKDM4EMAPTSMN1; SMN2
SCHEMBL8856340 0.86 CYSLTR2 (0.34)
SCHEMBL8856184 0.86 TRPV1 (0.39) TRPV1ALOX5PTGESPPARGPPARA
SCHEMBL8856277 0.86 KMT2A (0.44) TRPV1ATMALOX5PTGESPPARG
SCHEMBL8856357 0.86 TRPV1 (0.39) TRPV1ALOX5PTGESPPARGPPARA

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
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 claimed
EP-0418071-A2 New N-aryl and N-heteroarylamide and urea derivatives as inhibitors of acyl coenzyme A: cholesterol acyl transferase PFIZER INC. (US) 1991-03-20 EP claimed
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
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
EP-0418071-A2 New N-aryl and N-heteroarylamide and urea derivatives as inhibitors of acyl coenzyme A: cholesterol acyl transferase PFIZER INC. (US) 1991-03-20 EP disclosed