SCHEMBL410039

SCHEMBL410039

Cc1cc(C(=O)Nc2ccc(F)cc2C(F)(F)F)c2ccc(-c3ccc([C@H]4CC[C@H](CC(=O)O)CC4)cc3)cc2n1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 20/20 0.69
SOAT2 O75908 3/20 0.69
SOAT1 P35610 3/20 0.55

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
SCHEMBL10198067 1.00 DGAT1 (0.69) DGAT1SOAT2SOAT1
SCHEMBL410038 1.00 DGAT1 (0.69) DGAT1SOAT2SOAT1
SCHEMBL10197438 0.92 DGAT1 (0.57) DGAT1SOAT2SOAT1
SCHEMBL10258765 0.89 DGAT1 (0.55) DGAT1SOAT2SOAT1
SCHEMBL13190529 0.89 DGAT1 (0.52) DGAT1SOAT2SOAT1
SCHEMBL10261139 0.89 DGAT1 (0.54) DGAT1SOAT2SOAT1
SCHEMBL10260832 0.87 DGAT1 (0.53) DGAT1SOAT2SOAT1
SCHEMBL409260 0.87 DGAT1 (0.53) DGAT1SOAT2SOAT1
SCHEMBL409259 0.87 DGAT1 (0.53) DGAT1SOAT2SOAT1
SCHEMBL408127 0.86 DGAT1 (0.51) DGAT1SOAT2SOAT1

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
US-20120022057-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF DIACYGLYCEROL ACYLTRANSFERASE SCHERING CORPORATION (US) 2012-01-26 US disclosed
WO-2010107768-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE SCHERING CORPORATION (US) 2010-09-23 WO 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 (1 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-20120022057-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF DIACYGLYCEROL ACYLTRANSFERASE DGAT2, DGAT1, LCAT DGAT1 2/4885SOAT2 9/4885SOAT1 18/4885

“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.