SCHEMBL692762

SCHEMBL692762

O=C(c1ccccc1)N1CCC(Oc2cc[c]cc2)C1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.53
ACHE P22303 1/20 0.48
ALDH1A1 P00352 1/20 0.47
HTT P42858 1/20 0.47
LMNA P02545 1/20 0.47
SRD5A1 P18405 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
RIPK1 Q13546 1/20 0.45
EPHX1 P07099 1/20 0.45
L3MBTL3 Q96JM7 1/20 0.45
PDE4B Q07343 1/20 0.44
HRH3 Q9Y5N1 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ATM Q13315 1/20 0.43
PKM P14618 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL951722 1.00 NAMPT (0.53) NAMPTACHEALDH1A1HTTLMNA
SCHEMBL692763 1.00 NAMPT (0.53) NAMPTACHEALDH1A1HTTLMNA
SCHEMBL693657 0.92 ALDH1A1 (0.55) ACHEALDH1A1HTTLMNASRD5A1
SCHEMBL12442639 0.90 NAMPT (0.57) NAMPTACHEALDH1A1HTTLMNA
SCHEMBL2220012 0.84 ALDH1A1 (0.60) NAMPTACHEALDH1A1LMNAPDE4B
SCHEMBL2220004 0.84 ALDH1A1 (0.60) NAMPTACHEALDH1A1LMNAPDE4B
SCHEMBL14597201 0.82 ACHE (0.61) ACHEALDH1A1HTTLMNASRD5A1
SCHEMBL5986930 0.82 EPHX2 (0.52) NAMPTACHEALDH1A1HTTLMNA
SCHEMBL912119 0.79 L3MBTL3 (0.54) NAMPTALDH1A1HTTLMNAL3MBTL1
SCHEMBL911983 0.79 L3MBTL3 (0.54) NAMPTALDH1A1HTTLMNAL3MBTL1

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 NAMPT 4179/4885ACHE 65/4885ALDH1A1 364/4885
US-20130137674-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, LIPA NAMPT 4179/4885ACHE 65/4885ALDH1A1 364/4885

“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.