SCHEMBL8443141

SCHEMBL8443141

Cc1ccc(CN2CCC(CCCN3C(=O)CCc4ccccc43)CC2)cc1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 17/20 0.68
CHRM4 P08173 17/20 0.68
CHRM5 P08912 17/20 0.68
CHRM1 P11229 17/20 0.68
CHRM3 P20309 17/20 0.68
DRD4 P21917 16/20 0.67
DRD2 P14416 14/20 0.67
DRD3 P35462 14/20 0.67
ADRB2 P07550 2/20 0.67
ADRB1 P08588 2/20 0.67
ADRA1D P25100 2/20 0.67
ADRA1A P35348 2/20 0.67
ADRA1B P35368 2/20 0.67

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
SCHEMBL8445224 0.91 CHRM1 (0.74) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8442782 0.91 CHRM2 (0.69) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8443011 0.90 CHRM1 (0.68) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8442789 0.89 CHRM1 (0.64) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8445194 0.89 CHRM2 (0.64) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8442415 0.89 CHRM1 (0.67) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8445380 0.85 CHRM2 (0.68) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL14601865 0.85 CHRM2 (0.71) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL29400334 0.81 CHRM2 (1.00) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4100746 0.81 CHRM2 (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934932-A1 QUINOLINE DERIVATIVES AND PSYCHOTROPIC AGENT MEIJI SEIKA KABUSHIKI KAISHA (JP) 1999-08-11 EP claimed
EP-0934932-A1 QUINOLINE DERIVATIVES AND PSYCHOTROPIC AGENT MEIJI SEIKA KABUSHIKI KAISHA (JP) 1999-08-11 EP disclosed