SCHEMBL162497

SCHEMBL162497

COC(=O)CCCc1ncc(-c2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2)s1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.54
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NR1H4 Q96RI1 2/20 0.49
TRPV1 Q8NER1 7/20 0.48
TP53 P04637 1/20 0.47
HDAC3 O15379 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44

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
SCHEMBL160403 0.94 DGAT1 (0.56) DGAT1LMNAMAPTSMN1; SMN2NR1H4
SCHEMBL162665 0.90 NR1H4 (0.62) DGAT1NR1H4TRPV1HDAC3HDAC11
SCHEMBL160613 0.89 PTPN1 (0.50) DGAT1SMN1; SMN2NR1H4TRPV1
SCHEMBL161479 0.86 NR1H4 (0.61) DGAT1NR1H4TRPV1HDAC3HDAC11
SCHEMBL159279 0.86 TRPV1 (0.48) DGAT1SMN1; SMN2NR1H4TRPV1
SCHEMBL163250 0.84 DGAT1 (0.54) DGAT1LMNAMAPTSMN1; SMN2TRPV1
SCHEMBL161347 0.84 DGAT1 (0.54) DGAT1LMNAMAPTSMN1; SMN2TRPV1
SCHEMBL161921 0.83 SMN1; SMN2 (0.55) LMNAMAPTSMN1; SMN2NR1H4TRPV1
SCHEMBL161964 0.82 DGAT1 (0.56) DGAT1LMNAMAPTSMN1; SMN2TRPV1
SCHEMBL161164 0.82 DGAT1 (0.58) DGAT1NR1H4TRPV1HDAC3HDAC11

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 1/4885LMNA 2076/4885MAPT 137/4885

“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.