SCHEMBL26674397

SCHEMBL26674397

C[N+](C)(C)CCOCCOCl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 6/20 0.36
CHRM1 P11229 6/20 0.36
CHRM3 P20309 6/20 0.36
CHRM2 P08172 5/20 0.36
CHRM4 P08173 5/20 0.36
CHRNB2 P17787 4/20 0.36
CHRNA4 P43681 4/20 0.36
CHRNA7 P36544 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HTR1A P08908 2/20 0.36
ADRA2A P08913 1/20 0.36
ADRA1A P35348 1/20 0.36
PGR P06401 1/20 0.36
TBXA2R P21731 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA10 Q9GZZ6 1/20 0.36
CHRNA9 Q9UGM1 1/20 0.36
LMNA P02545 3/20 0.34
CYP2C19 P33261 2/20 0.34

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
SCHEMBL12560592 0.86 CHRM5 (0.43) CHRM5CHRM1CHRM3CHRM2CHRM4
Iodide SCHEMBL30166462 0.83 CHRM5 (0.42) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL22645 0.83
Hydrochloric Acid SCHEMBL28136226 0.83 CHRM5 (0.42) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL345651 0.83 CHRM5 (0.46) CHRM5CHRM1CHRM3CHRM2CHRM4
Bromide SCHEMBL3918164 0.80
Hydrochloric Acid SCHEMBL8996405 0.80
Hydrochloric Acid SCHEMBL692516 0.80
Hydrochloric Acid SCHEMBL28075634 0.80 CHRM5 (0.40) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL28191171 0.80

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
WO-2023222518-A1 COMPOSITE POWDER, IN PARTICULAR SUITABLE FOR ADDITIVE MANUFACTURING INSTITUT NATIONAL DE RECHERCHE POUR L'AGRICULTURE, L'ALIMENTATION ET L'ENVIRONNEMENT (FR) 2023-11-23 WO disclosed