SCHEMBL160146

SCHEMBL160146

CC(C(=O)OC(C)(C)C)N1CCC(c2ncc(-c3ccc(NC(=O)Nc4cc(F)c(F)cc4F)cc3)s2)CC1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 9/20 0.49
TRPV1 Q8NER1 3/20 0.36
TRPM8 Q7Z2W7 1/20 0.36
NTRK1 P04629 2/20 0.35
CTSC P53634 1/20 0.35
PTPN2 P17706 1/20 0.35
PTPN1 P18031 1/20 0.35
PTPN6 P29350 1/20 0.35
KDR P35968 3/20 0.34
BRAF P15056 1/20 0.34
AURKA O14965 1/20 0.34
FLT3 P36888 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 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
SCHEMBL161788 0.92 DGAT1 (0.50) DGAT1NTRK1KDR
SCHEMBL163107 0.91 DGAT1 (0.49) DGAT1TRPV1TRPM8KDRFLT3
SCHEMBL161574 0.89 DGAT1 (0.40) DGAT1TRPV1TRPM8PTPN2PTPN1
SCHEMBL15022043 0.89 DGAT1 (0.50) DGAT1TRPV1TRPM8NTRK1CTSC
SCHEMBL163321 0.89 DGAT1 (0.55) DGAT1TRPV1TRPM8KDRAURKA
SCHEMBL160759 0.86 DGAT1 (0.49) DGAT1TRPV1TRPM8KDR
SCHEMBL160147 0.84 DGAT1 (0.55) DGAT1TRPV1TRPM8NTRK1CTSC
SCHEMBL163421 0.83 DGAT1 (0.49) DGAT1NTRK1CTSCKDRBRAF
SCHEMBL164061 0.81 DGAT1 (0.51) DGAT1NTRK1KDR
SCHEMBL163448 0.81 DGAT1 (0.53) DGAT1CTSCCA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2611783-A2 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-07-10 EP claimed
US-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-06-20 US claimed
WO-2012029032-A2 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS PIRAMAL LIFE SCIENCES LIMITED (IN) 2012-03-08 WO claimed
EP-2611783-A2 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-07-10 EP disclosed
US-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-06-20 US disclosed
WO-2012029032-A2 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS PIRAMAL LIFE SCIENCES LIMITED (IN) 2012-03-08 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-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS DGAT1, DGAT2, SOAT1 DGAT1 1/4885TRPV1 2426/4885TRPM8 2723/4885

“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.