SCHEMBL4941297

SCHEMBL4941297

O=C(O)CC1CCC(c2ccc(-c3cc(OCc4cccc(OC(F)(F)F)c4)n[nH]3)cc2)CC1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 12/20 0.42
SOAT1 P35610 2/20 0.42
S1PR1 P21453 1/20 0.42
MRGPRX4 Q96LA9 2/20 0.41
JAK1 P23458 1/20 0.40
FFAR4 Q5NUL3 2/20 0.38
DHODH Q02127 1/20 0.37
FAAH O00519 1/20 0.37
CHRM2 P08172 1/20 0.37
DGAT2 Q96PD7 1/20 0.37
PDE10A Q9Y233 1/20 0.37

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
SCHEMBL4487832 0.87 DGAT1 (0.45) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL4475129 0.85 SLC6A4 (0.39) MRGPRX4JAK1DHODH
SCHEMBL4939698 0.84 DGAT1 (0.43) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL4936610 0.84 DGAT1 (0.54) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL4498652 0.80 DGAT1 (0.44) DGAT1SOAT1
SCHEMBL4482968 0.80 DGAT1 (0.44) DGAT1SOAT1
SCHEMBL4481941 0.79 DGAT1 (0.47) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL4472648 0.78 DGAT1 (0.43) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL14813144 0.78 DGAT1 (0.43) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL14813186 0.78 DGAT1 (0.45) DGAT1SOAT1FAAHCHRM2DGAT2

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
EP-2117526-B1 INHIBITORS OF DIACYLGLYCEROL O-ACYLTRANSFERASE TYPE 1 ENZYME ABBOTT LAB (US) 2013-04-03 EP claimed
US-20120238581-A1 INHIBITORS OF DIACYLGLYCEROL O-ACYLTRANSFERASE TYPE 1 ENZYME ABBVIE INC. 2012-09-20 US claimed
US-20080182861-A1 INHIBITORS OF DIACYLGLYCEROL O-ACYLTRANSFERASE TYPE 1 ENZYME ABBVIE INC. 2008-07-31 US claimed
US-8586594-B2 Inhibitors of diacylglycerol O-acyltransferase type 1 enzyme ABBVIE INC. (US) 2013-11-19 US disclosed
US-20120238581-A1 INHIBITORS OF DIACYLGLYCEROL O-ACYLTRANSFERASE TYPE 1 ENZYME ABBVIE INC. 2012-09-20 US disclosed
US-8202878-B2 Type 2 diabetes, obesity, elevated plasma triglycerides, metabolic syndrome, non-alcoholic steatohepatitis, and non-alcoholic fatty liver disease;Trans [4-(4-{3-[2-(1-adamantyl)-2-hydroxyethoxy]-1H-pyrazol-5-yl}phenyl)cyclohexyl]acetic acid ABBOTT LABORATORIES (US) 2012-06-19 US disclosed
US-20080182861-A1 INHIBITORS OF DIACYLGLYCEROL O-ACYLTRANSFERASE TYPE 1 ENZYME ABBVIE INC. 2008-07-31 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120238581-A1 INHIBITORS OF DIACYLGLYCEROL O-ACYLTRANSFERASE TYPE 1 ENZYME DGAT1, DGAT2, LCAT DGAT1 1/4885SOAT1 4/4885S1PR1 315/4885
US-20080182861-A1 INHIBITORS OF DIACYLGLYCEROL O-ACYLTRANSFERASE TYPE 1 ENZYME DGAT1, DGAT2, LCAT DGAT1 1/4885SOAT1 4/4885S1PR1 320/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.