SCHEMBL162764

SCHEMBL162764

CC(C)(C)OC(=O)CC1CCC(c2ncc(-c3ccc(NC(=O)Nc4ccccc4Cl)cc3)s2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 7/20 0.51
TEK Q02763 3/20 0.40
KIT P10721 1/20 0.40
KDR P35968 1/20 0.40
ALOX5 P09917 2/20 0.39
EPHX2 P34913 2/20 0.39
CNR1 P21554 1/20 0.39
MAPT P10636 5/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
LMNA P02545 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
TP53 P04637 2/20 0.39
EPHB4 P54760 1/20 0.39
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
POLB P06746 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 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
SCHEMBL160901 0.90 DGAT1 (0.50) DGAT1TEKKITKDRMAPT
SCHEMBL164578 0.87 DGAT1 (0.58) DGAT1TEKKITKDRALOX5
SCHEMBL163042 0.85 DGAT1 (0.52) DGAT1TEKKITKDRALOX5
SCHEMBL165240 0.85 DGAT1 (0.51) DGAT1MAPTMEN1KMT2ALMNA
SCHEMBL162634 0.84 DGAT1 (0.56) DGAT1TEKKITKDRCNR1
SCHEMBL158738 0.84 DGAT1 (0.51) DGAT1TEKKITKDRALOX5
SCHEMBL161666 0.83 DGAT1 (0.59) DGAT1TEKKITKDRALOX5
SCHEMBL160759 0.83 DGAT1 (0.49) DGAT1TEKKITKDRCNR1
SCHEMBL161895 0.82 DGAT1 (0.72) DGAT1TEKKITKDRCNR1
SCHEMBL174149 0.81 DGAT1 (0.55) DGAT1TEKKITKDRALOX5

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 1/4885TEK 3387/4885KIT 4789/4885

“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.