SCHEMBL4991791

SCHEMBL4991791

O=C(OC1C2CCC1NC2)[C@](O)(c1ccccc1)c1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 5/20 0.45
CHRM2 P08172 4/20 0.44
CHRM1 P11229 3/20 0.44
CHRM4 P08173 2/20 0.44
CHRM5 P08912 2/20 0.44
CYP2D6 P10635 1/20 0.42
SLC6A4 P31645 1/20 0.42
KCNH2 Q12809 1/20 0.42

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
SCHEMBL4182100 0.93 CHRM3 (0.49) CHRM3CHRM2CHRM1CHRM4CHRM5
SCHEMBL4984724 0.88 CHRM3 (0.45) CHRM3CHRM2CHRM1CHRM4CHRM5
SCHEMBL4984729 0.88 CHRM3 (0.45) CHRM3CHRM2CHRM1CHRM4CHRM5
SCHEMBL4184433 0.79 CHRM3 (0.42) CHRM3CHRM2CHRM1CHRM4CHRM5
SCHEMBL4200496 0.79 CHRM3 (0.52) CHRM3CHRM2CHRM1CHRM4CHRM5
SCHEMBL4183546 0.78 CHRM3 (0.52) CHRM3CHRM2CHRM1CHRM4CHRM5
SCHEMBL4985946 0.78 CHRM3 (0.52) CHRM3CHRM2CHRM1CHRM4CHRM5
SCHEMBL4982565 0.77 CHRM3 (0.51) CHRM3CHRM2CHRM1CHRM4CHRM5
SCHEMBL4987229 0.77 CHRM3 (0.51) CHRM3CHRM2CHRM1CHRM4CHRM5
SCHEMBL4987222 0.77 CHRM3 (0.51) CHRM3CHRM2CHRM1CHRM4CHRM5

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-1968980-A1 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES, LTD. (IN) 2008-09-17 EP disclosed
WO-2007110782-A1 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2007-10-04 WO disclosed