SCHEMBL159069

SCHEMBL159069

Cc1nnc(CC2CCC(c3ncc(-c4ccc(NC(=O)Nc5cc(F)c(F)cc5F)cc4)s3)CC2)o1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 10/20 0.49
CTSC P53634 1/20 0.37
NTRK1 P04629 1/20 0.36
KDR P35968 2/20 0.35
AURKA O14965 1/20 0.35
FLT3 P36888 1/20 0.35
ENPP2 Q13822 3/20 0.35
IDO1 P14902 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35

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
SCHEMBL159500 0.92 DGAT1 (0.51) DGAT1NTRK1IDO1
SCHEMBL162955 0.90 DGAT1 (0.47) DGAT1CTSCKDRAURKAFLT3
SCHEMBL162787 0.90 DGAT1 (0.41) DGAT1CTSCNTRK1KDRAURKA
SCHEMBL160576 0.88 DGAT1 (0.44) DGAT1KDRAURKAFLT3
SCHEMBL160838 0.87 DGAT1 (0.49) DGAT1CTSCKDRAURKAFLT3
SCHEMBL161809 0.86 DGAT1 (0.50) DGAT1KDRFLT3ENPP2
SCHEMBL159701 0.85 IL2 (0.39) DGAT1ENPP2
SCHEMBL15022217 0.85 DGAT1 (0.51) DGAT1CTSCNTRK1KDRAURKA
SCHEMBL162202 0.83 DGAT1 (0.57) DGAT1CTSCNTRK1KDRCA12
SCHEMBL163934 0.83 DGAT1 (0.53) DGAT1CTSCNTRK1KDRAURKA

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 1/4885CTSC 1668/4885NTRK1 4473/4885

“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.