SCHEMBL6229451

SCHEMBL6229451

CC[N+]12CCC(CC1)[C@@H](OC(=O)N(Cc1ccccc1)c1ccsc1)C2

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 20/20 0.64
CHRM1 P11229 20/20 0.64
CHRM3 P20309 20/20 0.64

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
SCHEMBL6229456 0.90 CHRM2 (0.77) CHRM2CHRM1CHRM3
SCHEMBL2828679 0.89 CHRM2 (0.66) CHRM2CHRM1CHRM3
SCHEMBL2832609 0.88 CHRM2 (0.64) CHRM2CHRM1CHRM3
SCHEMBL2832641 0.88 CHRM2 (0.81) CHRM2CHRM1CHRM3
SCHEMBL2816443 0.88 CHRM2 (0.61) CHRM2CHRM1CHRM3
SCHEMBL2813958 0.87 CHRM2 (0.84) CHRM2CHRM1CHRM3
SCHEMBL2832136 0.86 CHRM2 (0.77) CHRM2CHRM1CHRM3
SCHEMBL2830966 0.86 CHRM3 (0.69) CHRM2CHRM1CHRM3
Bromide SCHEMBL4954307 0.86 CHRM2 (0.84) CHRM2CHRM1CHRM3
SCHEMBL2830654 0.86 CHRM3 (0.58) 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