SCHEMBL162210

SCHEMBL162210

CCOC(=O)CN1CCC(c2nc(-c3ccc(NC(=O)Nc4ccccc4Cl)cc3)cs2)CC1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.45
RAB9A P51151 1/20 0.45
ROCK2 O75116 1/20 0.44
ROCK1 Q13464 1/20 0.44
CPT2 P23786 1/20 0.43
CPT1A P50416 1/20 0.43
ENPP2 Q13822 1/20 0.42
EPHB4 P54760 1/20 0.42
TEK Q02763 1/20 0.42
FAAH O00519 2/20 0.41
EPHX2 P34913 1/20 0.41
GAA P10253 1/20 0.41
TSHR P16473 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
SCN9A Q15858 1/20 0.41
PPARG P37231 1/20 0.41

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
SCHEMBL162044 0.90 ENPP2 (0.46) SMN1; SMN2NPC1RAB9AROCK1CPT2
SCHEMBL163021 0.89 ROCK2 (0.47) SMN1; SMN2NPC1TP53RAB9AROCK2
SCHEMBL162789 0.85 DGAT1 (0.50) SMN1; SMN2NPC1TP53RAB9ATEK
SCHEMBL161587 0.79 TRPV1 (0.49) SMN1; SMN2NPC1RAB9AROCK1CPT2
SCHEMBL161936 0.79 ENPP2 (0.50) SMN1; SMN2ENPP2FAAHTSHR
SCHEMBL163440 0.76 SMN1; SMN2 (0.54) SMN1; SMN2NPC1RAB9AENPP2GAA
SCHEMBL159031 0.75 DGAT1 (0.49) SMN1; SMN2NPC1RAB9ATEKTRPV1
SCHEMBL158884 0.73 DDX3X (0.48) NPC1TP53RAB9ATRPV1
SCHEMBL162142 0.72 DGAT1 (0.56) SMN1; SMN2NPC1TP53RAB9AEPHB4
SCHEMBL158368 0.71 DGAT1 (0.49) SMN1; SMN2NPC1TP53RAB9ATEK

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 SMN1; SMN2 2105/4885NPC1 86/4885TP53 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.