SCHEMBL2354399

SCHEMBL2354399

COC(=O)OC1CCN(OC)CC1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 2/20 0.34
SCN1A P35498 2/20 0.33
SCN2A Q99250 2/20 0.33
SCN3A Q9NY46 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CYP1A2 P05177 1/20 0.33
HIF1A Q16665 1/20 0.33
RAB9A P51151 1/20 0.32
EPHX1 P07099 1/20 0.32
CARM1 Q86X55 1/20 0.31
PRMT6 Q96LA8 1/20 0.31
MAOB P27338 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL1818116 0.82 SCN1A (0.49) CHRM3SCN1ASCN2ASCN3AMEN1
SCHEMBL697519 0.80
SCHEMBL1078014 0.80 EPHX1 (0.39) CHRM3MEN1KMT2ACHRM4CHRM5
SCHEMBL16845009 0.77 SMN1; SMN2 (0.47) CHRM3MEN1KMT2ACHRM4CHRM5
SCHEMBL19504740 0.77 ATM (0.42) CHRM3SCN1ASCN2ASCN3AMEN1
SCHEMBL698655 0.76
SCHEMBL10344338 0.76 EPHX1 (0.45) RAB9AEPHX1
SCHEMBL305953 0.76 EPHX1 (0.50) RAB9AEPHX1
SCHEMBL16845011 0.74 CHRM4 (0.50) CHRM3SCN1ASCN2ASCN3AMEN1
SCHEMBL10025768 0.74 EPHX2 (0.39) CYP1A2HIF1AEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2534147-A1 SPIROHETEROCYCLICAL SUBSTITUTED TETRAMIC ACID DERIVATIVES Bayer Intellectual Property GmbH (DE) 2012-12-19 EP disclosed
WO-2011098443-A1 SPIROHETEROCYCLICAL SUBSTITUTED TETRAMIC ACID DERIVATIVES BAYER CROPSCIENCE AG (DE) 2011-08-18 WO disclosed