SCHEMBL406146

SCHEMBL406146

CCc1ccccc1NC(=O)c1ccnc2cc(-c3ccc([C@H]4CC[C@H](CC(=O)O)CC4)cc3)ccc12

nearest known ligand 0.78

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 20/20 0.78
SOAT1 P35610 1/20 0.78
SOAT2 O75908 2/20 0.61
EGFR P00533 1/20 0.53
INSR P06213 1/20 0.53
PTGIR P43119 1/20 0.53
CASP9 P55211 1/20 0.53
CASP8 Q14790 1/20 0.53

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
SCHEMBL10198035 1.00 DGAT1 (0.78) DGAT1SOAT1SOAT2EGFRINSR
SCHEMBL406145 1.00 DGAT1 (0.78) DGAT1SOAT1SOAT2EGFRINSR
SCHEMBL410210 0.94 DGAT1 (0.74) DGAT1SOAT1SOAT2EGFRINSR
SCHEMBL10198040 0.94 DGAT1 (0.74) DGAT1SOAT1SOAT2EGFRINSR
SCHEMBL410211 0.94 DGAT1 (0.74) DGAT1SOAT1SOAT2EGFRINSR
SCHEMBL10197379 0.92 DGAT1 (0.65) DGAT1SOAT1SOAT2EGFRINSR
SCHEMBL383896 0.88 DGAT1 (0.75) DGAT1SOAT1SOAT2EGFRINSR
SCHEMBL10198027 0.88 DGAT1 (0.75) DGAT1SOAT1SOAT2EGFRINSR
SCHEMBL383895 0.88 DGAT1 (0.75) DGAT1SOAT1SOAT2EGFRINSR
SCHEMBL10198337 0.88 DGAT1 (0.65) DGAT1SOAT1SOAT2EGFRINSR

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 1 patent. 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

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 2/4885SOAT1 18/4885SOAT2 9/4885

“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.