SCHEMBL160969

SCHEMBL160969

CS(=O)(=O)N1CCC(c2ncc(-c3ccc(NC(=O)Nc4c(F)cc(F)cc4F)cc3)s2)CC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.45
DGAT1 O75907 6/20 0.43
TP53 P04637 1/20 0.41
EPHX2 P34913 2/20 0.40
AURKA O14965 1/20 0.39
KDR P35968 1/20 0.39
FLT3 P36888 1/20 0.39
CYP11B2 P19099 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TDO2 P48775 1/20 0.38
ALDH1A1 P00352 1/20 0.37
CYP2C19 P33261 1/20 0.37
CYP11B1 P15538 2/20 0.37
MAPK1 P28482 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL161432 0.90 DGAT1 (0.55) NPY5RDGAT1TP53MEN1KMT2A
SCHEMBL162160 0.90 DGAT1 (0.42) NPY5RDGAT1EPHX2AURKAKDR
SCHEMBL163448 0.88 DGAT1 (0.53) NPY5RDGAT1TP53EPHX2MEN1
SCHEMBL162679 0.86 DGAT1 (0.53) DGAT1EPHX2KDRMEN1KMT2A
SCHEMBL161055 0.85 DGAT1 (0.45) DGAT1AURKAKDRFLT3
SCHEMBL162248 0.85 DGAT1 (0.45) DGAT1EPHX2AURKAKDRFLT3
SCHEMBL159576 0.84 DGAT1 (0.45) DGAT1EPHX2AURKAKDRFLT3
SCHEMBL160846 0.83 PTPN2 (0.46) DGAT1TP53ALDH1A1CYP2C19
SCHEMBL162204 0.82 DGAT1 (0.41) DGAT1EPHX2AURKAKDRFLT3
SCHEMBL163877 0.82 ALDH1A1 (0.41) DGAT1EPHX2AURKAKDRFLT3

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 NPY5R 3189/4885DGAT1 1/4885TP53 1654/4885

“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.