SCHEMBL2129647

SCHEMBL2129647

O=C(c1ccccc1)N1CC[C@H](NC2CN(C(=O)c3cc4ccc(-c5cccc(C(F)(F)F)c5)cc4s3)C2)C1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 8/20 0.45
ADAMTS7 Q9UKP4 1/20 0.45
ADAMTS5 Q9UNA0 1/20 0.45
GHSR Q92847 1/20 0.43
RBP4 P02753 1/20 0.42
RIPK1 Q13546 1/20 0.41
SYK P43405 1/20 0.41
SLC6A7 Q99884 1/20 0.41
MGLL Q99685 2/20 0.40
UBE2M P61081 1/20 0.40
DCUN1D1 Q96GG9 1/20 0.40
CYP2D6 P10635 1/20 0.39
MCHR1 Q99705 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL2722500 1.00 CCR2 (0.45) CCR2ADAMTS7ADAMTS5GHSRRBP4
SCHEMBL2131092 0.93 CCR2 (0.45) CCR2ADAMTS7ADAMTS5GHSRRBP4
SCHEMBL2722933 0.93 CCR2 (0.45) CCR2ADAMTS7ADAMTS5GHSRRBP4
SCHEMBL2130863 0.93 MCHR1 (0.42) CCR2ADAMTS7ADAMTS5RIPK1MGLL
SCHEMBL2722386 0.93 MCHR1 (0.42) CCR2ADAMTS7ADAMTS5RIPK1MGLL
SCHEMBL2130918 0.91 CHRNA7 (0.45) CCR2RBP4MGLLKMT2A
SCHEMBL2720564 0.91 CHRNA7 (0.45) CCR2RBP4MGLLKMT2A
SCHEMBL2133096 0.90 PTPN2 (0.43) MGLLKMT2A
SCHEMBL2132024 0.87 ADAMTS7 (0.54) CCR2ADAMTS7ADAMTS5GHSRRBP4
SCHEMBL2721726 0.87 ADAMTS7 (0.54) CCR2ADAMTS7ADAMTS5GHSRRBP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8748417-B2 Amino-pyrrolidine-azetidine diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2014-06-10 US claimed
US-8575363-B2 Amino-pyrrolidine-azetidine diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2013-11-05 US claimed
US-20130196970-A1 AMINO-PYRROLIDINE-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA, NV (BE) 2013-08-01 US claimed
US-20120101081-A1 AMINO-PYRROLIDINE-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA, NV (BE) 2012-04-26 US claimed
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 CCR2 2148/4885ADAMTS7 3352/4885ADAMTS5 2700/4885
US-20120101081-A1 AMINO-PYRROLIDINE-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, MGLL CCR2 2148/4885ADAMTS7 3352/4885ADAMTS5 2700/4885

“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.