SCHEMBL8856146

SCHEMBL8856146

CCCCCCCCC(Sc1ccccc1)C(=O)OC

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 11/20 0.52
▸ PPARA Q07869 9/20 0.52
▸ ALOX5 P09917 9/20 0.52
▸ PTGES O14684 6/20 0.49
▸ MMP9 P14780 1/20 0.47
▸ MMP13 P45452 1/20 0.47
▸ ADAM17 P78536 1/20 0.47
▸ ZDHHC7 Q9NXF8 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ PAX8 Q06710 1/20 0.46
▸ PRSS1 P07477 1/20 0.44
▸ PRSS2 P07478 1/20 0.44
▸ PRSS3 P35030 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ CNR2 P34972 1/20 0.43

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
SCHEMBL22612343 0.85 PPARG (0.64) PPARGPPARAALOX5PTGES
SCHEMBL9099026 0.85 PPARG (0.64) PPARGPPARAALOX5PTGES
SCHEMBL9099036 0.85 PPARG (0.64) PPARGPPARAALOX5PTGES
SCHEMBL8356987 0.85 PPARG (0.64) PPARGPPARAALOX5PTGES
SCHEMBL10498869 0.83 NPC1 (0.46) PPARGPPARAALOX5PTGESMMP9
SCHEMBL5081085 0.83 PPARG (0.66) PPARGPPARAALOX5PTGES
SCHEMBL10403934 0.83 PPARG (0.47) PPARGPPARAALOX5PTGESMMP9
SCHEMBL10498132 0.79 PPARG (0.48) PPARGPPARAALOX5PTGESMMP9
SCHEMBL5080497 0.79 PPARG (0.72) PPARGPPARAALOX5PTGES
SCHEMBL7656991 0.78 PPARG (0.56) PPARGPPARAALOX5PTGESMMP9

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-5498786-A Synthesis of intermediates in the preparation of ACAT inhibitors PFIZER INC. (US) 1996-03-12 — — US disclosed
EP-0569482-B1 SYNTHESIS OF INTERMEDIATES IN THE PREPARATION OF ACAT INHIBITORS PFIZER (US) 1995-08-02 — — 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
WO-1992013843-A1 SYNTHESIS OF INTERMEDIATES IN THE PREPARATION OF ACAT INHIBITORS PFIZER INC. (US) 1992-08-20 — — WO disclosed
Send feedback