SCHEMBL2917413

SCHEMBL2917413

CC(C)CCCCCCC1(C(=O)O)CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 2/20 0.47
CETP P11597 4/20 0.46
CYP2C19 P33261 1/20 0.44
CYP4F2 P78329 5/20 0.42
CYP4A11 Q02928 5/20 0.42
BLM P54132 1/20 0.38
KDM4C Q9H3R0 2/20 0.35
MME P08473 1/20 0.35
KDM4A O75164 1/20 0.35
PHF8 Q9UPP1 1/20 0.35
KDM2A Q9Y2K7 1/20 0.35
CPB2 Q96IY4 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
SCHEMBL6798544 0.96 CETP (0.45) TBXAS1CETPCYP2C19CYP4F2CYP4A11
SCHEMBL31157050 0.91 BLM (0.41) TBXAS1CETPCYP2C19CYP4F2CYP4A11
SCHEMBL30959045 0.91 BLM (0.41) TBXAS1CETPCYP2C19CYP4F2CYP4A11
SCHEMBL31157063 0.91 BLM (0.41) TBXAS1CETPCYP2C19CYP4F2CYP4A11
SCHEMBL31157055 0.91 BLM (0.41) TBXAS1CETPCYP2C19CYP4F2CYP4A11
SCHEMBL31157064 0.91 BLM (0.41) TBXAS1CETPCYP2C19CYP4F2CYP4A11
SCHEMBL5520693 0.85 CYP2C19 (0.50) TBXAS1CETPCYP2C19CYP4F2CYP4A11
SCHEMBL9177719 0.85 CYP2C19 (0.58) TBXAS1CETPCYP2C19CYP4F2CYP4A11
SCHEMBL9182262 0.85 CYP2C19 (0.58) TBXAS1CETPCYP2C19CYP4F2CYP4A11
SCHEMBL798202 0.83 TBXAS1 (0.54) TBXAS1CYP2C19CYP4F2CYP4A11CPB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2220154-A1 C7-C12 SECONDARY ALCOHOL ESTERS OF CYCLOHEXANOIC ACID ExxonMobil Chemical Patents Inc. (US) 2010-08-25 EP disclosed
WO-2009070398-A1 C7-C12 SECONDARY ALCOHOL ESTERS OF CYCLOHEXANOIC ACID EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-06-04 WO disclosed