SCHEMBL7099567

SCHEMBL7099567

O=C(OC1CC(=O)N(O)C1=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
CHRNA7 P36544 2/20 0.42
HTR3E A5X5Y0 1/20 0.42
HTR3B O95264 1/20 0.42
HTR3A P46098 1/20 0.42
HTR3D Q70Z44 1/20 0.42
HTR3C Q8WXA8 1/20 0.42
CHRM2 P08172 2/20 0.42
CHRM4 P08173 2/20 0.42
CHRM1 P11229 2/20 0.42
CHRM3 P20309 2/20 0.42
APOBEC3A P31941 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
LMNA P02545 2/20 0.40
F2 P00734 1/20 0.40
SLC18A3 Q16572 1/20 0.40
GAA P10253 1/20 0.40
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL24223726 0.83 ALDH1A1 (0.49) KMT2AMEN1CHRNA7HTR3EHTR3B
SCHEMBL9774300 0.83 KMT2A (0.42) KMT2AMEN1CHRNA7HTR3EHTR3B
SCHEMBL9534617 0.77 CHRNA7 (0.40) KMT2AMEN1CHRNA7HTR3EHTR3B
SCHEMBL22571124 0.77 ALDH1A1 (0.56) KMT2AMEN1CHRNA7GAAALDH1A1
SCHEMBL22571125 0.77 ALDH1A1 (0.56) KMT2AMEN1CHRNA7GAAALDH1A1
SCHEMBL637765 0.75 LMNA (0.47) KMT2AMEN1CHRNA7HTR3EHTR3B
SCHEMBL637338 0.75 LMNA (0.47) KMT2AMEN1CHRNA7HTR3EHTR3B
SCHEMBL2239675 0.75 LMNA (0.47) KMT2AMEN1CHRNA7HTR3EHTR3B
SCHEMBL1934695 0.75 MCL1 (0.46) KMT2AMEN1LMNAGAAALDH1A1
Ammonia Solution, Strong SCHEMBL28851009 0.73 MCL1 (0.45) KMT2AMEN1LMNASLC18A3GAA

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
EP-1342714-A1 Process for producing azine compounds and oxime compounds Daicel Chemical Industries, Ltd. (JP) 2003-09-10 EP disclosed