SCHEMBL5594162

SCHEMBL5594162

NC(=O)ON=C1CCCC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
FAAH O00519 1/20 0.48
ABHD16A O95870 1/20 0.48
KMT2A Q03164 1/20 0.48
PLA2G7 Q13093 1/20 0.48
NCEH1 Q6PIU2 1/20 0.48
DAGLB Q8NCG7 1/20 0.48
DAGLA Q9Y4D2 1/20 0.48
RAB9A P51151 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
GAA P10253 1/20 0.47
ALDH1A1 P00352 1/20 0.44
NPC1 O15118 1/20 0.44
TSHR P16473 1/20 0.36
CASP1 P29466 1/20 0.36

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
SCHEMBL5593997 0.98 KMT2A (0.52) MEN1FAAHABHD16AKMT2APLA2G7
SCHEMBL212464 0.78 RAB9A (0.47) MEN1FAAHABHD16AKMT2APLA2G7
SCHEMBL213364 0.76 MEN1 (0.50) MEN1FAAHABHD16AKMT2APLA2G7
SCHEMBL214510 0.76 MEN1 (0.50) MEN1FAAHABHD16AKMT2APLA2G7
SCHEMBL212465 0.76 MEN1 (0.50) MEN1FAAHABHD16AKMT2APLA2G7
SCHEMBL215531 0.76 MEN1 (0.50) MEN1FAAHABHD16AKMT2APLA2G7
SCHEMBL212565 0.76 MEN1 (0.50) MEN1FAAHABHD16AKMT2APLA2G7
SCHEMBL172304 0.70
SCHEMBL9010403 0.70 MEN1 (0.45) MEN1FAAHABHD16AKMT2APLA2G7
SCHEMBL10891059 0.70 MEN1 (0.45) MEN1FAAHABHD16AKMT2APLA2G7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007072089-A1 MGLUR5 ANTAGONISTIC CARBAMOYL-OXIME DERIVATIVES RICHTER GEDEON VEGYÉSZETU GYÁR RT. (HU) 2007-06-28 WO disclosed