SCHEMBL7067261

SCHEMBL7067261

CCCCC1CCN(CCCC(N2CCC(CCCC)CC2)n2c(=O)sc3ccccc32)CC1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 4/20 0.45
CHRM2 P08172 3/20 0.45
CHRM4 P08173 3/20 0.45
CHRM5 P08912 3/20 0.45
DRD2 P14416 3/20 0.45
CHRM3 P20309 3/20 0.45
DRD4 P21917 3/20 0.45
ADRA1D P25100 2/20 0.45
ADRA1A P35348 2/20 0.45
ADRA1B P35368 2/20 0.45
DRD3 P35462 2/20 0.45
ADRB2 P07550 1/20 0.45
ADRB1 P08588 1/20 0.45
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
ADRA2B P18089 1/20 0.44
HRH1 P35367 1/20 0.44
HRH3 Q9Y5N1 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
SCHEMBL2149904 0.81 SIGMAR1 (0.58)
SCHEMBL3031779 0.81 HTR1A (0.60) HTR1A
SCHEMBL6454535 0.81 SIGMAR1 (0.44)
SCHEMBL3034131 0.80 HTR1A (0.60) HTR1A
SCHEMBL2150203 0.80 HTR1A (0.60) HTR1A
SCHEMBL2149110 0.80 DRD2 (0.54) DRD2DRD4
SCHEMBL7131386 0.76 CHRM1 (0.42) CHRM1CHRM2CHRM4CHRM5DRD2
SCHEMBL3036381 0.74 HTR1A (0.43) HTR1A
SCHEMBL2149636 0.74 HTR1A (0.43) HTR1A
SCHEMBL3040576 0.74 HTR1A (0.43) HTR1A

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-2004089942-A2 BENZIMIDAZOLIDINONE DERIVATIVES AS MUSCARINIC AGENTS ACADIA PHARMACEUTICALS INC. (US) 2004-10-21 WO disclosed