SCHEMBL11235939

SCHEMBL11235939

CC(C)(C)/C(Cn1cccn1)=N\O

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.35
NOS1 P29475 4/20 0.35
NOS3 P29474 1/20 0.35
TSHR P16473 2/20 0.33
BRD4 O60885 1/20 0.32
GLS O94925 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL11235953 1.00 FDPS (0.35) FDPSNOS1NOS3TSHRBRD4
SCHEMBL11246274 0.83 NOS1 (0.32) FDPSNOS1NOS3TSHR
SCHEMBL11229989 0.83 NOS1 (0.35) FDPSNOS1NOS3TSHR
SCHEMBL11246276 0.83 NOS1 (0.32) FDPSNOS1NOS3TSHR
SCHEMBL11230004 0.83 NOS1 (0.35) FDPSNOS1NOS3TSHR
SCHEMBL11245459 0.81 NOS3 (0.31) FDPSNOS1NOS3
SCHEMBL11250045 0.81 NOS3 (0.31) FDPSNOS1NOS3
SCHEMBL11250048 0.81 NOS3 (0.31) FDPSNOS1NOS3
SCHEMBL11245461 0.81 NOS3 (0.31) FDPSNOS1NOS3
SCHEMBL11225802 0.76 NOS1 (0.41) FDPSNOS1NOS3TSHRBRD4

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