SCHEMBL2145504

SCHEMBL2145504

O=C(O)c1oc(N2CCC(c3ccc(F)cc3)CC2)nc1C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 16/20 0.55
RXFP1 Q9HBX9 1/20 0.40
LCAT P04180 1/20 0.40
MLYCD O95822 1/20 0.39
SOAT2 O75908 1/20 0.37
SOAT1 P35610 1/20 0.37
NOTUM Q6P988 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
SCHEMBL2145686 0.91 DGAT1 (0.62) DGAT1RXFP1LCATMLYCDSOAT2
SCHEMBL12246277 0.90 DGAT1 (0.52) DGAT1RXFP1LCATMLYCDSOAT2
SCHEMBL2145954 0.87 DGAT1 (0.48) DGAT1
SCHEMBL2145775 0.87 DGAT1 (0.50) DGAT1LCAT
SCHEMBL13366319 0.85 DGAT1 (0.42) DGAT1NOTUM
SCHEMBL12246295 0.84 DGAT1 (0.55) DGAT1RXFP1LCATMLYCD
SCHEMBL2380357 0.83 DGAT1 (0.50) DGAT1RXFP1MLYCD
SCHEMBL12246303 0.82 DGAT1 (0.51) DGAT1RXFP1LCATMLYCDNOTUM
SCHEMBL12246291 0.80 DGAT1 (0.49) DGAT1RXFP1LCAT
SCHEMBL2145146 0.80 MEN1 (0.50) DGAT1

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-20110224136-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE MERCK SHARP & DOHME CORP 2011-09-15 US disclosed
US-20110224136-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE MERCK SHARP & DOHME CORP 2011-09-15 US disclosed
US-20110224136-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE MERCK SHARP & DOHME CORP 2011-09-15 US disclosed
EP-2346853-A2 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE Schering Corporation (US) 2011-07-27 EP disclosed
WO-2010059606-A2 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE SCHERING CORPORATION (US) 2010-05-27 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-20110224136-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE DGAT2, DGAT1, LCAT DGAT1 2/4885RXFP1 3398/4885LCAT 3/4885

“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.