SCHEMBL160753

SCHEMBL160753

COC(=O)C1CCC(c2ncc(-c3ccc(NC(=O)c4ccc(C(C)(C)C)cc4)cc3)s2)CC1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.52
TRPV1 Q8NER1 6/20 0.47
TP53 P04637 1/20 0.45
LMNA P02545 2/20 0.42
HDAC3 O15379 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
NAMPT P43490 1/20 0.42
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL161218 0.90 DGAT1 (0.56) DGAT1TRPV1
SCHEMBL173720 0.88 DGAT1 (0.56) DGAT1TRPV1LMNAHDAC3HDAC11
SCHEMBL162685 0.81 DGAT1 (0.46) DGAT1MAPTSMN1; SMN2
SCHEMBL161939 0.81 DGAT1 (0.56) DGAT1TRPV1NAMPT
SCHEMBL162147 0.81 SMO (0.48) DGAT1TP53LMNASMN1; SMN2
SCHEMBL160635 0.81 CNR1 (0.50) DGAT1TP53MAPTSMN1; SMN2
SCHEMBL174553 0.80 DGAT1 (0.46) DGAT1LMNA
SCHEMBL164651 0.79 KMT2A (0.50) TRPV1TP53LMNAMAPT
SCHEMBL160162 0.79 NPC1 (0.45) DGAT1LMNAMAPTSMN1; SMN2
SCHEMBL15022054 0.79 CNR1 (0.41) DGAT1SMN1; SMN2

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 1/4885TRPV1 2426/4885TP53 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.