SCHEMBL4898459

SCHEMBL4898459

c1ccc([N+]23CCC(CC2)CC3)cc1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.33
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA4 P43681 1/20 0.33
CHRNA10 Q9GZZ6 1/20 0.33
CHRNA9 Q9UGM1 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
SCHEMBL4903817 0.81 ALDH1A1 (0.33) CHRNA7ACHECHRNB2CHRNB4CHRNA3
SCHEMBL4903936 0.70 CHKA (0.36) CHRNB4CHRNA3
SCHEMBL4898465 0.70 CHRNA3 (0.48) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL19579581 0.65
SCHEMBL2344944 0.65 BCHE (0.65) CHRNA7BCHEACHECHRNB2CHRNB4
Water SCHEMBL31012149 0.64 BCHE (0.62) CHRNA7BCHEACHECHRNB2CHRNB4
Bromide SCHEMBL6889492 0.64 BCHE (0.68) CHRNA7BCHEACHECHRNB2CHRNB4
SCHEMBL4893829 0.64 CYP1A2 (0.35) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL15282149 0.64 CYP1A2 (0.35) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL692081 0.63 CHRM3 (0.50) CHRNA7BCHEACHECHRNB2CHRNB4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1867667-B1 Method for manufacturing stabilized polyacetal resin POLYPLASTICS CO (JP) 2012-10-31 EP disclosed
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
EP-1867667-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) 2007-12-19 EP disclosed