SCHEMBL6229872

SCHEMBL6229872

CC[N+]12CCC(CC1)[C@@H](OC(=O)N(CCc1ccccc1)c1ccccc1)C2

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 20/20 0.75
CHRM1 P11229 20/20 0.75
CHRM3 P20309 20/20 0.75
CHRM4 P08173 1/20 0.56
CHRM5 P08912 1/20 0.56

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
SCHEMBL2828287 0.88 CHRM2 (0.85) CHRM2CHRM1CHRM3
SCHEMBL2832676 0.88 CHRM2 (0.84) CHRM2CHRM1CHRM3
SCHEMBL2832071 0.87 CHRM2 (0.67) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL2832575 0.87 CHRM2 (0.66) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL2834080 0.86 CHRM2 (1.00) CHRM2CHRM1CHRM3
SCHEMBL2816384 0.86 CHRM2 (0.82) CHRM2CHRM1CHRM3
Bromide SCHEMBL6079001 0.85 CHRM2 (0.82) CHRM2CHRM1CHRM3
SCHEMBL2829593 0.85 CHRM2 (0.74) CHRM2CHRM1CHRM3
SCHEMBL2814020 0.85 CHRM2 (1.00) CHRM2CHRM1CHRM3
SCHEMBL2829053 0.85 CHRM3 (0.69) CHRM2CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1515968-A2 QUINUCLIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME Almirall Prodesfarma AG (CH) 2005-03-23 EP disclosed
WO-2004000840-A2 QUINUCLIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME ALMIRALL PRODESFARMA AG (CH) 2003-12-31 WO disclosed