SCHEMBL11225802

SCHEMBL11225802

C/C(Cn1cccn1)=N\O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 4/20 0.41
NOS3 P29474 1/20 0.41
FDPS P14324 1/20 0.38
TSHR P16473 2/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
BRD4 O60885 1/20 0.34
GLS O94925 1/20 0.33
ALDH1A1 P00352 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL11225805 1.00 NOS1 (0.41) NOS1NOS3FDPSTSHRMEN1
SCHEMBL19148215 0.81 THRB (0.40) NOS1NOS3FDPSTSHRMEN1
SCHEMBL27677685 0.79
SCHEMBL11248685 0.76 FDPS (0.39) NOS1NOS3FDPSTSHRBRD4
SCHEMBL11235939 0.76 FDPS (0.35) NOS1NOS3FDPSTSHRMEN1
SCHEMBL11235953 0.76 FDPS (0.35) NOS1NOS3FDPSTSHRMEN1
SCHEMBL11248682 0.76 FDPS (0.39) NOS1NOS3FDPSTSHRBRD4
SCHEMBL11971222 0.75
SCHEMBL27978032 0.75
SCHEMBL10650114 0.75

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
US-4359469-A Combating pests with N-sulphenylated oxime-carbamates BAYER AKTIENGESELLSCHAFT (DE) 1982-11-16 US disclosed