SCHEMBL693535

SCHEMBL693535

CC(=O)N1CCC(OC2=CC[CH]C=C2)CC1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 2/20 0.39
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
CYP11B2 P19099 1/20 0.36
NAMPT P43490 2/20 0.36
CHUK O15111 1/20 0.36
RORC P51449 1/20 0.35
PDE4B Q07343 1/20 0.35

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
SCHEMBL693658 0.80 ACHE (0.49) NAMPT
SCHEMBL5761963 0.77 HRH3 (0.44)
SCHEMBL694872 0.75 QDPR (0.43)
SCHEMBL2091338 0.68 EPHX2 (0.57) IKBKBCYP4F2CYP4A11NAMPTCHUK
SCHEMBL2480403 0.68 CASP6 (0.42)
SCHEMBL2481875 0.67 SLC6A4 (0.32)
SCHEMBL9013886 0.67 CASP6 (0.53) IKBKBCYP4F2CYP4A11NAMPTRORC
SCHEMBL2478239 0.67 SLC6A4 (0.33)
SCHEMBL16220677 0.67 EPHX2 (0.56) CYP4F2CYP4A11NAMPTRORC
SCHEMBL14590499 0.67 EPHX2 (0.53) IKBKBCYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2421824-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP claimed
WO-2010124114-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO claimed
EP-2421824-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP disclosed
WO-2010124114-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO disclosed