SCHEMBL14648025

SCHEMBL14648025

O=C(c1ccc2nc(-c3nccs3)sc2c1)N1CC(N2CCN(C(=O)c3nccs3)CC2)C1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 14/20 0.61
FAAH O00519 1/20 0.56
HPGD P15428 2/20 0.45
ALDH1A1 P00352 1/20 0.42
ABL1 P00519 2/20 0.41
BCR P11274 2/20 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
SCHEMBL699341 0.90 MGLL (0.70) MGLLFAAHALDH1A1
SCHEMBL14647963 0.89 MGLL (0.61) MGLLFAAHHPGDALDH1A1
SCHEMBL14647957 0.87 MGLL (0.60) MGLLFAAH
SCHEMBL14647852 0.86 MGLL (0.60) MGLLFAAHALDH1A1
SCHEMBL694415 0.82 MGLL (0.55) MGLLFAAHHPGDALDH1A1
SCHEMBL911814 0.81 MGLL (0.59) MGLLFAAHHPGDALDH1A1
SCHEMBL696441 0.77 ABL1 (0.59) MGLLFAAHHPGDABL1BCR
SCHEMBL699388 0.77 MGLL (0.58) MGLLHPGDALDH1A1
SCHEMBL7784149 0.77 MGLL (0.66) MGLLFAAHALDH1A1
SCHEMBL913057 0.77 MGLL (0.61) MGLLFAAH

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-2421823-B1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2015-01-14 EP disclosed
EP-2421825-B9 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2014-08-20 EP disclosed
US-8691805-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2014-04-08 US disclosed
EP-2421825-B1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2014-01-01 EP disclosed
US-20130244997-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (US) 2013-09-19 US disclosed
US-8362000-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2013-01-29 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-20130244997-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, LIPA MGLL 5/4885FAAH 104/4885HPGD 731/4885

“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.