SCHEMBL4896775

SCHEMBL4896775

COCC[N+]12CCC(CC1)CC2

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
CHRNA7 P36544 2/20 0.39
CHRNB2 P17787 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA4 P43681 1/20 0.39
CHRNA10 Q9GZZ6 1/20 0.39
CHRNA9 Q9UGM1 1/20 0.39
CHRM3 P20309 2/20 0.37
CHKA P35790 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
SCHEMBL4900378 0.82 KDM4E (0.48) KDM4ECHRM3
SCHEMBL4905061 0.77 CHRNA7 (0.37) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL19812389 0.76 CHRNB2 (0.36) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL4906320 0.72 CHRNA7 (0.41) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL4902080 0.71 KDM4E (0.40) KDM4ECHRM3
SCHEMBL4907268 0.71 CHKA (0.44) KDM4ECHRM3CHKA
SCHEMBL1666073 0.69 CHRNA7 (0.36) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL12036494 0.69 CHRNA7 (0.36) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
Bromide SCHEMBL7629729 0.69 CHRNA7 (0.36) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
Water SCHEMBL31012145 0.69 CHRNA7 (0.36) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4

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-20080271381-A1 Method for manufacturing stabilized polyacetal resin, stabilized polyacetal resin, stabilized polyacetal resin composition, and molded article of stabilized polyacetal resin POLYPLASTICS CO., LTD (JP) 2008-11-06 US disclosed