SCHEMBL2132159

SCHEMBL2132159

Cc1c(C(=O)N2CC(N[C@H]3CCN(C(=O)c4ccccc4)C3)C2)sc2ccc(-c3ccc(F)cc3)cc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ATM Q13315 1/20 0.41
PIK3CD O00329 2/20 0.41
DGAT1 O75907 1/20 0.40
PTPN1 P18031 2/20 0.39
SMO Q99835 1/20 0.39
PRSS12 P56730 1/20 0.38
PTPN2 P17706 1/20 0.38
PIK3CA P42336 1/20 0.38
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38
DRD3 P35462 1/20 0.38
ADAMTS4 O75173 1/20 0.38
MMP1 P03956 1/20 0.38
ADAM17 P78536 1/20 0.38
ADAMTS1 Q9UHI8 1/20 0.38
ADAMTS7 Q9UKP4 1/20 0.38
ADAMTS5 Q9UNA0 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
SCHEMBL2733650 1.00 HSD11B1 (0.42) HSD11B1NPC1RAB9AATMPIK3CD
SCHEMBL2131592 0.95 PIK3CD (0.42) PIK3CDDGAT1PTPN1PTPN2PIK3CA
SCHEMBL2133298 0.93 PIK3CD (0.41) HSD11B1RAB9APIK3CDDGAT1PIK3CA
SCHEMBL2133254 0.91 MCHR1 (0.42) PIK3CDSMODRD2DRD4ADAMTS4
SCHEMBL2136227 0.88 ADAMTS7 (0.43) SMOADAMTS7ADAMTS5
SCHEMBL2129161 0.88 PIK3CD (0.41) HSD11B1NPC1RAB9AATMPIK3CD
SCHEMBL2137397 0.88 LMNA (0.44) HSD11B1NPC1RAB9AATMPIK3CD
SCHEMBL2133554 0.86 PRSS12 (0.42) PRSS12EPHX1
SCHEMBL2133028 0.85 EPHX1 (0.44) NPC1RAB9APIK3CDPRSS12PIK3CA
SCHEMBL2143188 0.85 EPHX1 (0.44) NPC1RAB9APIK3CDPRSS12PIK3CA

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 HSD11B1 973/4885NPC1 710/4885RAB9A 348/4885
US-20120101081-A1 AMINO-PYRROLIDINE-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, MGLL HSD11B1 973/4885NPC1 710/4885RAB9A 348/4885

“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.