SCHEMBL11519950

SCHEMBL11519950

C=C(C)C(=O)N(CO)C(C)=O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 3/20 0.33
CHRM4 P08173 3/20 0.33
CHRM5 P08912 3/20 0.33
CHRM1 P11229 3/20 0.33
CHRM3 P20309 3/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL10909009 0.81 CHRM2 (0.31) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8413747 0.80 CHRM1 (0.40) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL11517907 0.79 ALDH1A1 (0.32) TDP1
SCHEMBL7643150 0.78 ALDH1A1 (0.35)
SCHEMBL2184776 0.75 MAPT (0.33) TDP1
SCHEMBL10783976 0.75 TDP1 (0.36) CHRM2TDP1
SCHEMBL11417281 0.74 TDP1 (0.36) TDP1
SCHEMBL263104 0.74 TDP1 (0.36) TDP1
SCHEMBL1412786 0.72
SCHEMBL28730604 0.72 TDP1 (0.37) TDP1

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-4145500-A Stabilization of crosslinkable polymers BAYER AKTIENGESELLSCHAFT (DE) 1979-03-20 US disclosed