SCHEMBL868263

SCHEMBL868263

O=C(c1ccc2nc(-c3ccccc3)oc2c1)N1CC(N2CCN(c3nccs3)C(=O)C2)C1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 18/20 0.71
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SLC6A7 Q99884 1/20 0.41

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
SCHEMBL868229 0.93 MGLL (0.72) MGLLNPC1RAB9ASLC6A7
SCHEMBL868055 0.84 SLC6A7 (0.58) MGLLSLC6A7
SCHEMBL868911 0.83 MGLL (0.49) MGLLNPC1RAB9ASLC6A7
SCHEMBL912419 0.83 MGLL (1.00) MGLL
SCHEMBL912226 0.83 MGLL (1.00) MGLL
SCHEMBL911993 0.79 MGLL (0.77) MGLL
SCHEMBL142962 0.78 MGLL (0.75) MGLLNPC1RAB9A
SCHEMBL911854 0.77 MGLL (0.87) MGLL
SCHEMBL911371 0.75 MGLL (1.00) MGLL
SCHEMBL2731418 0.75 MGLL (0.79) MGLLNPC1RAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8637498-B2 Oxopiperazine-azetidine amides and oxodiazepine-azetidine amides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2014-01-28 US disclosed
US-20120077797-A1 OXOPIPERAZINE-AZETIDINE AMIDES AND OXODIAZEPINE-AZETIDINE AMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2012-03-29 US 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-20120077797-A1 OXOPIPERAZINE-AZETIDINE AMIDES AND OXODIAZEPINE-AZETIDINE AMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS LPL, PNLIP, LIPA MGLL 6/4885NPC1 200/4885RAB9A 1108/4885

“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.