SCHEMBL8442415

SCHEMBL8442415

O=C1CCc2ccccc2N1CCCC1CCN(Cc2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 17/20 0.67
CHRM2 P08172 16/20 0.67
CHRM4 P08173 16/20 0.67
CHRM5 P08912 16/20 0.67
CHRM3 P20309 16/20 0.67
DRD2 P14416 13/20 0.63
DRD4 P21917 12/20 0.63
DRD3 P35462 12/20 0.63
ADRB2 P07550 2/20 0.63
ADRB1 P08588 2/20 0.63
ADRA1D P25100 2/20 0.63
ADRA1A P35348 2/20 0.63
ADRA1B P35368 2/20 0.63
HTR2A P28223 1/20 0.51
HTR2C P28335 1/20 0.51
HTR2B P41595 1/20 0.51
SIGMAR1 Q99720 1/20 0.51
GRIN1 Q05586 1/20 0.48
GRIN2B Q13224 1/20 0.48

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
SCHEMBL8443011 0.91 CHRM1 (0.68) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL8445224 0.91 CHRM1 (0.74) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL8442782 0.90 CHRM2 (0.69) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL8443141 0.89 CHRM2 (0.68) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL8445194 0.86 CHRM2 (0.64) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL14601865 0.84 CHRM2 (0.71) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL8442789 0.82 CHRM1 (0.64) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL8445380 0.80 CHRM2 (0.68) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL8576227 0.80 CHRM1 (0.56) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL8445209 0.79 CHRM1 (0.63) CHRM1CHRM2CHRM4CHRM5CHRM3

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