SCHEMBL2134194

SCHEMBL2134194

O=C(O)NC1CCN(C(=O)c2nccs2)C1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.52
RBP4 P02753 1/20 0.46
CYP2C9 P11712 1/20 0.45
KDM1A O60341 1/20 0.41
KDM5A P29375 6/20 0.41
SMO Q99835 1/20 0.41
MGLL Q99685 3/20 0.39
KDM5B Q9UGL1 1/20 0.39
ADORA2B P29275 1/20 0.39
GAA P10253 1/20 0.38
HPGD P15428 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
SCHEMBL2133933 0.85 CYP3A4 (0.48) CYP3A4RBP4CYP2C9KDM1AKDM5A
SCHEMBL2610258 0.82 ADORA2A (0.53) CYP3A4RBP4CYP2C9ADORA2B
SCHEMBL2130529 0.81 CYP3A4 (0.46) CYP3A4RBP4CYP2C9KDM1AKDM5A
SCHEMBL2130521 0.81 CYP3A4 (0.46) CYP3A4RBP4CYP2C9KDM1AKDM5A
SCHEMBL2130300 0.78 RBP4 (0.50) CYP3A4RBP4CYP2C9SMOMGLL
SCHEMBL2130297 0.78 RBP4 (0.50) CYP3A4RBP4CYP2C9SMOMGLL
SCHEMBL2131175 0.77 CYP3A4 (0.55) CYP3A4RBP4CYP2C9KDM1ASMO
SCHEMBL2618734 0.76 PARP1 (0.46) CYP3A4RBP4ADORA2B
SCHEMBL2719436 0.75 RBP4 (0.50) CYP3A4RBP4SMOMGLLGAA
SCHEMBL16334556 0.74 TNKS (0.42) CYP3A4MGLLHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103261189-B Amino-pyrrolidine-azetidine diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA NV 2015-01-28 CN disclosed
US-8748417-B2 Amino-pyrrolidine-azetidine diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2014-06-10 US disclosed
US-8575363-B2 Amino-pyrrolidine-azetidine diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2013-11-05 US disclosed
EP-2630139-A1 AMINO-PYRROLIDINE-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica, N.V. (BE) 2013-08-28 EP disclosed
US-20130196970-A1 AMINO-PYRROLIDINE-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA, NV (BE) 2013-08-01 US disclosed
US-20120101081-A1 AMINO-PYRROLIDINE-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA, NV (BE) 2012-04-26 US disclosed
WO-2012054721-A1 AMINO-PYRROLIDINE-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICAL NV (BE) 2012-04-26 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 (2 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-20130196970-A1 AMINO-PYRROLIDINE-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, MGLL CYP3A4 2393/4885RBP4 3161/4885CYP2C9 592/4885
US-20120101081-A1 AMINO-PYRROLIDINE-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, MGLL CYP3A4 2393/4885RBP4 3161/4885CYP2C9 592/4885

“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.