SCHEMBL6992770

SCHEMBL6992770

O=C(OC12CCN(CC1)C2)N(Cc1ccccc1)c1ccccc1.O=C(OC12CCN(CC1)CC2)N(Cc1ccccc1)c1ccccc1.O=C(O[C@H]1CN2CCC1CC2)N(Cc1ccco1)Cc1ccco1.O=C(O[C@H]1CN2CCC1CC2)N(Cc1ccco1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 20/20 0.60
CHRM1 P11229 20/20 0.60
CHRM3 P20309 20/20 0.60
CHRM5 P08912 3/20 0.45
CHRM4 P08173 2/20 0.45

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
SCHEMBL6989646 0.85 CHRM2 (0.49) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL2832680 0.83 CHRM2 (0.72) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL2831960 0.79 CHRM2 (0.65) CHRM2CHRM1CHRM3
SCHEMBL2828617 0.78 CHRM2 (1.00) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL1924243 0.78 CHRM2 (1.00) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL1926099 0.78 CHRM2 (1.00) CHRM2CHRM1CHRM3CHRM5CHRM4
Hydrochloric Acid SCHEMBL1926555 0.77 CHRM2 (0.98) CHRM2CHRM1CHRM3CHRM5CHRM4
Hydrochloric Acid SCHEMBL1925445 0.77 CHRM2 (0.98) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL2832567 0.76 CHRM2 (0.54) CHRM2CHRM1CHRM3
SCHEMBL2829226 0.74 CHRM2 (0.53) 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-1345937-A1 QUINUCLIDINE CARBAMATE DERIVATIVES AND THEIR USE AS M3 ANTAGONISTS Almirall Prodesfarma, S.A. (ES) 2003-09-24 EP claimed
WO-2002051841-A1 QUINUCLIDINE CARBAMATE DERIVATIVES AND THEIR USE AS M3 ANTAGONISTS ALMIRALL PRODESFARMA AG (CH) 2002-07-04 WO claimed