SCHEMBL693534

SCHEMBL693534

CC(=O)N1CCC(Oc2cc[c]cc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.48
CYP4A11 Q02928 1/20 0.48
NAMPT P43490 1/20 0.47
GPR119 Q8TDV5 2/20 0.46
IKBKB O14920 2/20 0.46
CHEK2 O96017 1/20 0.46
HRH3 Q9Y5N1 2/20 0.45
RORC P51449 1/20 0.44
OXTR P30559 1/20 0.43
AVPR1A P37288 1/20 0.43
CHUK O15111 1/20 0.43
KMT2A Q03164 1/20 0.42
EPHX2 P34913 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
SCHEMBL1898217 0.84 GPR119 (0.43) GPR119HRH3KMT2AEPHX2
SCHEMBL3319822 0.84 F10 (0.43) GPR119HRH3
SCHEMBL2091338 0.84 EPHX2 (0.57) CYP4F2CYP4A11NAMPTIKBKBRORC
SCHEMBL9013886 0.83 CASP6 (0.53) CYP4F2CYP4A11NAMPTIKBKBCHEK2
SCHEMBL16220677 0.83 EPHX2 (0.56) CYP4F2CYP4A11NAMPTCHEK2HRH3
SCHEMBL951540 0.82 GPR119 (0.67) GPR119CHEK2
SCHEMBL24596887 0.81 CYP4F2 (0.51) CYP4F2CYP4A11NAMPTGPR119IKBKB
Hydrochloric Acid SCHEMBL9014030 0.81 CASP6 (0.51) CYP4F2CYP4A11NAMPTIKBKBCHEK2
SCHEMBL2096831 0.81 EPHX2 (0.55) CYP4F2CYP4A11NAMPTCHEK2EPHX2
SCHEMBL31370640 0.81 ALDH1A1 (0.55) CYP4F2CYP4A11NAMPTIKBKBCHEK2

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-8399454-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2013-03-19 US claimed
EP-2421824-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP claimed
US-20110015170-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2011-01-20 US claimed
WO-2010124114-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO claimed
US-8722658-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2014-05-13 US disclosed
US-20130137674-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA, NV (US) 2013-05-30 US disclosed
US-8399454-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2013-03-19 US disclosed
EP-2421824-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP disclosed
US-20110015170-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2011-01-20 US disclosed
WO-2010124114-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 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-20110015170-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, LIPA CYP4F2 2276/4885CYP4A11 1661/4885NAMPT 4179/4885
US-20130137674-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, LIPA CYP4F2 2276/4885CYP4A11 1661/4885NAMPT 4179/4885

“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.