SCHEMBL6437590

SCHEMBL6437590

CCCCC1CCN(CCCn2c(=O)ccc3cccc(F)c32)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 10/20 0.47
CHRM5 P08912 7/20 0.47
CHRM3 P20309 7/20 0.47
CHRM2 P08172 6/20 0.47
CHRM4 P08173 6/20 0.47
DRD2 P14416 5/20 0.47
DRD4 P21917 5/20 0.47
DRD3 P35462 4/20 0.47
ADRA1D P25100 2/20 0.47
ADRA1A P35348 2/20 0.47
ADRA1B P35368 2/20 0.47
ADRB2 P07550 1/20 0.47
ADRB1 P08588 1/20 0.47
HTR1A P08908 1/20 0.43
ADRA2A P08913 1/20 0.43
ADRA2B P18089 1/20 0.43
HRH1 P35367 1/20 0.43
HRH3 Q9Y5N1 2/20 0.43
KCNH2 Q12809 1/20 0.38
HTR2C P28335 1/20 0.37

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
SCHEMBL6438231 0.88 CHRM1 (0.52) CHRM1CHRM5CHRM3CHRM2CHRM4
SCHEMBL6438606 0.87 CHRM1 (0.47) CHRM1CHRM5CHRM3CHRM2CHRM4
SCHEMBL6441749 0.85 CHRM1 (0.45) CHRM1CHRM5CHRM3CHRM2CHRM4
SCHEMBL4090351 0.82 CHRM1 (0.53) CHRM1CHRM5CHRM3CHRM2CHRM4
SCHEMBL4101982 0.80 CHRM1 (0.55) CHRM1CHRM5CHRM3CHRM2CHRM4
SCHEMBL4095848 0.79 CHRM1 (0.54) CHRM1CHRM5CHRM3CHRM2CHRM4
SCHEMBL4106718 0.77 CHRM1 (0.45) CHRM1CHRM5CHRM3CHRM2CHRM4
SCHEMBL4102226 0.76 CHRM1 (0.46) CHRM1CHRM5CHRM3CHRM2CHRM4
SCHEMBL3021062 0.76 CHRM1 (0.46) CHRM1CHRM5CHRM3CHRM2CHRM4
SCHEMBL4098178 0.75 CHRM1 (0.52) CHRM1CHRM5CHRM3CHRM2CHRM4

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-1461318-B9 TETRAHYDROQUINOLINE ANALOGUES AS MUSCARINIC AGONISTS ACADIA PHARM INC (US) 2005-12-28 EP claimed
EP-1461318-B1 TETRAHYDROQUINOLINE ANALOGUES AS MUSCARINIC AGONISTS ACADIA PHARM INC (US) 2005-09-14 EP claimed