SCHEMBL144125

SCHEMBL144125

CN(Cc1ccccc1)C1CN(C(=O)O)C1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.51
NAAA Q02083 1/20 0.50
JAK2 O60674 1/20 0.50
JAK1 P23458 1/20 0.50
OPRM1 P35372 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
AGTR2 P50052 2/20 0.46
SLC18A3 Q16572 1/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
CA12 O43570 1/20 0.45
CA9 Q16790 1/20 0.45
MCHR1 Q99705 1/20 0.44
GRIN2B Q13224 1/20 0.43
HPGD P15428 1/20 0.43
NAMPT P43490 1/20 0.42

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
SCHEMBL17274372 0.91 NAAA (0.63) KMT2ANAAAJAK2JAK1MCHR1
SCHEMBL146819 0.90 CCR5 (0.47) KMT2ANAAAJAK2JAK1OPRM1
SCHEMBL28568035 0.88 JAK2 (0.64) KMT2ANAAAJAK2JAK1OPRM1
SCHEMBL18424508 0.88 KMT2A (0.56) KMT2AJAK2JAK1OPRM1SIGMAR1
SCHEMBL28568037 0.88 JAK2 (0.64) KMT2ANAAAJAK2JAK1OPRM1
SCHEMBL785972 0.84 JAK2 (0.54) KMT2AJAK2JAK1OPRM1SIGMAR1
SCHEMBL2732891 0.82 KMT2A (0.46) KMT2ANAAAJAK2JAK1OPRM1
SCHEMBL25176973 0.82 SLC18A3 (0.48) KMT2AJAK2JAK1OPRM1SIGMAR1
SCHEMBL21517972 0.82 NAAA (0.43) KMT2ANAAAJAK2JAK1OPRM1
SCHEMBL21517973 0.82 NAAA (0.43) KMT2ANAAAJAK2JAK1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2611774-B1 DI-AZETIDINYL DIAMIDE AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2015-03-18 EP disclosed
US-8759333-B2 Di-azetidinyl diamide as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2014-06-24 US disclosed
US-8759533-B2 Di-azetidinyl diamide as monoacylglcerol lipase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2014-06-24 US disclosed
US-20130196969-A1 DI-AZETIDINYL DIAMIDE AS MONOACYLGLCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA, NV (BE) 2013-08-01 US disclosed
US-20130196968-A1 DI-AZETIDINYL DIAMIDE AS MONOACYLGLCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA, NV (BE) 2013-08-01 US disclosed
EP-2611774-A1 DI-AZETIDINYL DIAMIDE AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica, N.V. (BE) 2013-07-10 EP disclosed
WO-2012030907-A1 DI-AZETIDINYL DIAMIDE AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2012-03-08 WO disclosed
US-20120058986-A1 DI-AZETIDINYL DIAMIDE AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2012-03-08 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 (3 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-20130196969-A1 DI-AZETIDINYL DIAMIDE AS MONOACYLGLCEROL LIPASE INHIBITORS MGLL, PNLIP, LPL KMT2A 2355/4885NAAA 73/4885JAK2 2693/4885
US-20130196968-A1 DI-AZETIDINYL DIAMIDE AS MONOACYLGLCEROL LIPASE INHIBITORS MGLL, PNLIP, LPL KMT2A 2355/4885NAAA 73/4885JAK2 2693/4885
US-20120058986-A1 DI-AZETIDINYL DIAMIDE AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, LIPA KMT2A 2049/4885NAAA 112/4885JAK2 2177/4885

“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.