SCHEMBL4636648

SCHEMBL4636648

CC(C)=CCC[N+]12CCC(CC1)[C@@H](OC(=O)C1c3ccccc3CCc3ccccc31)C2

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 20/20 0.56
CHRM2 P08172 11/20 0.53
CHRM1 P11229 9/20 0.53

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
Bromide SCHEMBL4636339 0.99 CHRM3 (0.55) CHRM3CHRM2CHRM1
SCHEMBL4636863 0.87 CHRM3 (0.71) CHRM3CHRM2CHRM1
Bromide SCHEMBL4636585 0.86 CHRM3 (0.71) CHRM3CHRM2CHRM1
SCHEMBL72305 0.81 CHRM3 (0.77) CHRM3CHRM2CHRM1
SCHEMBL72306 0.81 CHRM3 (0.77) CHRM3CHRM2CHRM1
Bromide SCHEMBL4636518 0.81 CHRM3 (0.55) CHRM3CHRM2CHRM1
SCHEMBL4636900 0.80 CHRM3 (0.60) CHRM3CHRM2CHRM1
Bromide SCHEMBL4636555 0.79 CHRM3 (0.60) CHRM3CHRM2CHRM1
Bromide SCHEMBL4636355 0.78 CHRM3 (0.50) CHRM3CHRM2CHRM1
SCHEMBL72075 0.78 CHRM3 (0.59) CHRM3CHRM2CHRM1

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-1725552-B1 NEW QUATERNIZED QUINUCLIDINE ESTERS ALMIRALL LAB (ES) 2008-06-25 EP claimed