SCHEMBL8323636

SCHEMBL8323636

CCCCCCCC(CCCCCCC)C(=O)Nc1c(SC)cc(C)nc1SC

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 6/20 0.38
HDAC8 Q9BY41 5/20 0.37
HDAC3 O15379 3/20 0.37
HDAC6 Q9UBN7 3/20 0.37
HDAC1 Q13547 2/20 0.37
HDAC2 Q92769 2/20 0.37
LMNA P02545 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
HDAC4 P56524 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34

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
SCHEMBL9225723 0.90 SOAT1 (0.38) SOAT1
SCHEMBL8325248 0.89 SOAT1 (0.37) SOAT1LMNA
SCHEMBL8322961 0.87 SOAT1 (0.36) SOAT1LMNA
SCHEMBL8321429 0.86 SOAT1 (0.35) SOAT1
SCHEMBL8324413 0.86 SOAT1 (0.35) SOAT1
SCHEMBL8319650 0.86 SOAT1 (0.38) SOAT1LMNA
SCHEMBL6123211 0.86 SOAT1 (0.38) SOAT1LMNA
SCHEMBL8321431 0.86 SOAT1 (0.38) SOAT1LMNA
SCHEMBL8322963 0.84 SOAT1 (0.34) SOAT1LMNA
SCHEMBL9000693 0.83 EPHX1 (0.37) SOAT1

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-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
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