SCHEMBL162084

SCHEMBL162084

O=C(Nc1ccc(-c2cnc(C3CCC(C(=O)O)CC3)s2)cc1)Nc1cc(F)cc(F)c1

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 14/20 0.71
CNR1 P21554 1/20 0.40
SYK P43405 1/20 0.40
KDR P35968 4/20 0.38
KIT P10721 1/20 0.38
BRAF P15056 1/20 0.38
AURKA O14965 1/20 0.38
FLT3 P36888 1/20 0.38

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
SCHEMBL163926 0.92 DGAT1 (0.61) DGAT1KDRKITAURKA
SCHEMBL174097 0.89 DGAT1 (0.58) DGAT1KDRKITBRAFAURKA
SCHEMBL163070 0.89 DGAT1 (0.59) DGAT1CNR1KDRKIT
SCHEMBL162577 0.89 DGAT1 (0.56) DGAT1CNR1KDRKITAURKA
SCHEMBL161973 0.88 DGAT1 (0.69) DGAT1CNR1KDRAURKAFLT3
SCHEMBL164677 0.88 DGAT1 (0.73) DGAT1
SCHEMBL163439 0.87 DGAT1 (0.55) DGAT1CNR1
SCHEMBL165743 0.87 DGAT1 (0.73) DGAT1CNR1KDRBRAF
SCHEMBL162706 0.87 DGAT1 (0.59) DGAT1CNR1KDRAURKAFLT3
SCHEMBL162401 0.86 DGAT1 (0.58) DGAT1CNR1SYKKDRAURKA

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 1/4885CNR1 946/4885SYK 4548/4885

“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.