SCHEMBL163271

SCHEMBL163271

O=C(O)CCCc1ncc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)cc2)s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.58
MAPT P10636 3/20 0.53
MEN1 O00255 2/20 0.53
HTT P42858 2/20 0.53
KMT2A Q03164 2/20 0.53
RAB9A P51151 1/20 0.53
EPHX2 P34913 1/20 0.52
KDR P35968 7/20 0.50
TEK Q02763 3/20 0.49
CDK8 P49336 3/20 0.49
CDK7 P50613 1/20 0.49
CDK6 Q00534 1/20 0.49
RIPK1 Q13546 1/20 0.48
JAK2 O60674 1/20 0.48
NTRK1 P04629 1/20 0.48
RET P07949 1/20 0.48
PDGFRB P09619 1/20 0.48
NTRK3 Q16288 1/20 0.48
NTRK2 Q16620 1/20 0.48
AURKB Q96GD4 1/20 0.48

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
SCHEMBL163790 0.94 DGAT1 (0.60) DGAT1MAPTMEN1HTTKMT2A
SCHEMBL158826 0.90 DGAT1 (0.56) DGAT1MAPTMEN1HTTKMT2A
SCHEMBL158665 0.86 DGAT1 (0.57) DGAT1MAPTMEN1HTTKMT2A
SCHEMBL166036 0.85 DGAT1 (0.59) DGAT1MAPTMEN1HTTKMT2A
SCHEMBL161640 0.85 MAPT (0.53) DGAT1MAPTMEN1HTTKMT2A
SCHEMBL162096 0.83 DGAT1 (0.59) DGAT1MAPTMEN1HTTKMT2A
SCHEMBL161478 0.82 DGAT1 (0.56) DGAT1MAPTRAB9AKDRCDK8
SCHEMBL162156 0.81 DGAT1 (0.55) DGAT1MAPTMEN1HTTKMT2A
SCHEMBL158944 0.78 DGAT1 (0.58) DGAT1MAPTMEN1KMT2ARAB9A
SCHEMBL164942 0.78 DGAT1 (0.55) DGAT1MAPTMEN1HTTKMT2A

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 1/4885MAPT 137/4885MEN1 2803/4885

“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.