SCHEMBL8488704

SCHEMBL8488704

CCOC(=O)N1CCCC(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)C1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 10/20 0.80
CHRM2 P08172 5/20 0.80
CHRM4 P08173 5/20 0.80
CHRM3 P20309 4/20 0.80
CHRM5 P08912 3/20 0.80
ALDH1A1 P00352 3/20 0.55
KDM4E B2RXH2 1/20 0.55
PMP22 Q01453 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
SLC18A3 Q16572 1/20 0.54
ADRA1D P25100 2/20 0.54
ADRA1A P35348 2/20 0.54
ADRA1B P35368 2/20 0.54
DRD2 P14416 1/20 0.54
HTR2C P28335 1/20 0.54
CYP3A4 P08684 1/20 0.52
CALCRL Q16602 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
HSD11B1 P28845 2/20 0.52

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
SCHEMBL13243429 0.95 CHRM1 (0.88) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL3003287 0.95 CHRM1 (0.88) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL13243457 0.95 CHRM1 (0.88) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL6580373 0.89 CHRM1 (1.00) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL4669587 0.86 CHRM1 (0.91) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL13243458 0.85 CHRM1 (0.70) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL3411560 0.85 CHRM1 (0.70) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL3000147 0.84 CHRM1 (0.70) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL2998817 0.83 CHRM1 (0.68) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL2998805 0.83 CHRM1 (0.68) CHRM1CHRM2CHRM4CHRM3CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999032481-A1 MUSCARINIC AGENTS AND USE THEREOF TO TREAT GLAUCOMA, MYOPIA AND VARIOUS OTHER CONDITIONS ALCON LABORATORIES, INC. (US) 1999-07-01 WO disclosed