SCHEMBL163071

SCHEMBL163071

O=COC1CCC(c2ncc(-c3ccc(NC(=O)Nc4ccc(F)c(F)c4)cc3)s2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 7/20 0.44
KCNJ6 P48051 3/20 0.39
KCNJ5 P48544 3/20 0.39
KCNJ3 P48549 3/20 0.39
KDR P35968 2/20 0.39
EPHB4 P54760 2/20 0.39
TEK Q02763 2/20 0.39
EGFR P00533 1/20 0.39
PDGFRB P09619 1/20 0.39
KIT P10721 1/20 0.39
FGFR1 P11362 1/20 0.39
FLT1 P17948 1/20 0.39
BLM P54132 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MTOR P42345 1/20 0.39
JAK1 P23458 1/20 0.38
CNR1 P21554 1/20 0.38
CSGALNACT1 Q8TDX6 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
SCHEMBL15022085 0.91 DGAT1 (0.55) DGAT1KDRPDGFRBNPC1RAB9A
SCHEMBL162085 0.90 DGAT1 (0.53) DGAT1KDRTEKPDGFRBKIT
SCHEMBL174659 0.89 CNR1 (0.49) DGAT1KDRRAB9ASMN1; SMN2CNR1
SCHEMBL173788 0.89 KDR (0.45) DGAT1KDREPHB4TEKEGFR
SCHEMBL162707 0.89 DGAT1 (0.44) DGAT1KDREPHB4TEKEGFR
SCHEMBL162774 0.88 DGAT1 (0.43) DGAT1CNR1CTSCMAPT
SCHEMBL162781 0.88 DGAT1 (0.47) DGAT1KDREPHB4TEKSMN1; SMN2
SCHEMBL161554 0.88 NPC1 (0.48) DGAT1KDREPHB4TEKEGFR
SCHEMBL164678 0.87 DGAT1 (0.56) DGAT1NPC1RAB9ASMN1; SMN2MTOR
SCHEMBL161827 0.86 DGAT1 (0.47) DGAT1KCNJ6KCNJ5KCNJ3KDR

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 1/4885KCNJ6 3077/4885KCNJ5 2690/4885

“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.