SCHEMBL4648241

SCHEMBL4648241

Cc1cc2c(cc1F)[nH]c(=O)n2C1CCN(C(=O)OCC(C)C)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 3/20 0.56
CHRM4 P08173 3/20 0.56
CHRM5 P08912 3/20 0.56
CHRM1 P11229 3/20 0.56
CHRM3 P20309 3/20 0.56
KCNH2 Q12809 1/20 0.56
HSD11B1 P28845 6/20 0.49
OPRM1 P35372 5/20 0.47
OPRD1 P41143 2/20 0.47
OPRK1 P41145 2/20 0.47
OPRL1 P41146 1/20 0.46
HTR1A P08908 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
TACR2 P21452 1/20 0.43
DRD1 P21728 1/20 0.43
DRD5 P21918 1/20 0.43
SLC6A2 P23975 1/20 0.43
ADRA1D P25100 1/20 0.43
HTR1B P28222 1/20 0.43
TSPO P30536 1/20 0.43

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
SCHEMBL4648437 0.89 OPRM1 (0.50) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4747240 0.88 OPRM1 (0.53) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4647578 0.88 CHRM1 (0.52) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4648973 0.88 CHRM1 (0.49) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4648458 0.86 CHRM1 (0.49) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4745949 0.84 OPRM1 (0.64) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4645974 0.83 CHRM1 (0.59) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4605846 0.82 CHRM2 (0.47) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4649387 0.81 CHRM1 (0.46) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4646443 0.81 OPRM1 (0.48) CHRM2CHRM4CHRM5CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008119721-A1 COMPOUNDS WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE GLAXO GROUP LIMITED (GB) 2008-10-09 WO disclosed
WO-2008119720-A1 1-(1-CYCLOBUTYL-4-PIPERIDINYL)-1,3-DIHYDRO-2H-BENZIMIDAZOL-2-ONE DERIVATIVES WHICH HAVE ACTIVITY ON THE M1 RECEPTOR AND THEIR USE IN MEDICINE GLAXO GROUP LIMITED (GB) 2008-10-09 WO disclosed
EP-1960389-A2 COMPOUNDS WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE GLAXO GROUP LIMITED (GB) 2008-08-27 EP disclosed
WO-2007036718-A2 COMPOUNDS WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE GLAXO GROUP LIMITED (GB) 2007-04-05 WO disclosed