SCHEMBL161468

SCHEMBL161468

Cc1ccc(Cl)c(NC(=O)Nc2ccc(-c3cnc(C4CCC(OC=O)CC4)s3)cc2)c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 8/20 0.42
NTRK1 P04629 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MAPT P10636 3/20 0.38
CSF1R P07333 1/20 0.38
PKM P14618 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDR P35968 5/20 0.37
PDGFRB P09619 2/20 0.37
AURKA O14965 1/20 0.37
KIT P10721 1/20 0.37
FLT3 P36888 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
SCHEMBL161554 0.91 NPC1 (0.48) DGAT1NTRK1NPC1RAB9AMAPT
SCHEMBL174149 0.88 DGAT1 (0.55) DGAT1NPC1RAB9AMAPTKDR
SCHEMBL162339 0.87 MAPT (0.42) DGAT1MAPTPKMKDRAURKA
SCHEMBL163045 0.86 DGAT1 (0.47) DGAT1NTRK1NPC1RAB9AMAPT
SCHEMBL161467 0.86 DGAT1 (0.57) DGAT1NTRK1NPC1RAB9AMAPT
SCHEMBL174659 0.86 CNR1 (0.49) DGAT1RAB9AMAPTSMN1; SMN2KDR
SCHEMBL165053 0.85 DGAT1 (0.42) DGAT1KDR
SCHEMBL163680 0.85 DGAT1 (0.47) DGAT1RAB9AMAPTCSF1R
SCHEMBL162085 0.84 DGAT1 (0.53) DGAT1KDRPDGFRBAURKAKIT
SCHEMBL162781 0.84 DGAT1 (0.47) DGAT1NTRK1MAPTSMN1; SMN2KDR

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 1/4885NTRK1 4473/4885NPC1 86/4885

“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.