SCHEMBL20020153

SCHEMBL20020153

CCCCc1noc(CC(=O)OCC)n1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
PKM P14618 1/20 0.35
ATM Q13315 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KDM4E B2RXH2 1/20 0.35
APLNR P35414 1/20 0.35

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
SCHEMBL12205176 0.78 SMN1; SMN2 (0.43) SMN1; SMN2CA12CA1CA2CA9
SCHEMBL14374427 0.78 CHRM2 (0.38) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL7953996 0.77 ALDH1A1 (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL24386849 0.76 CA12 (0.43) SMN1; SMN2CA12CA1CA2CA9
SCHEMBL15932331 0.76 HTT (0.46) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6623047 0.75 SMN1; SMN2 (0.45) SMN1; SMN2CA12CA1CA2CA9
SCHEMBL5635294 0.75 SMN1; SMN2 (0.49) SMN1; SMN2TSHRMAPK1
Hydrochloric Acid SCHEMBL6324469 0.75 CA12 (0.42) SMN1; SMN2CA12CA1CA2CA9
SCHEMBL19416950 0.74 CHRM2 (0.40) SMN1; SMN2CHRM2CHRM4CHRM5CHRM1
SCHEMBL9253828 0.73 MAPK1 (0.44) CA12CA1CA2CA9TSHR

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-2952096-B1 Amide compound, an arthropod pest control agent and a method for controlling arthropod pest SUMITOMO CHEMICAL CO (JP) 2018-04-04 EP disclosed