SCHEMBL8199191

SCHEMBL8199191

CN(CCc1ccc(N)cc1)C1CCC(C(C(N)=O)(c2ccccc2)c2ccccc2)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.38
CHRM4 P08173 2/20 0.38
CHRM5 P08912 2/20 0.38
ADRA2C P18825 2/20 0.38
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRA2A P08913 1/20 0.38
CHRM1 P11229 1/20 0.38
DRD2 P14416 1/20 0.38
KCNE1 P15382 1/20 0.38
ADRA2B P18089 1/20 0.38
CHRM3 P20309 1/20 0.38
HRH2 P25021 1/20 0.38
HTR2A P28223 1/20 0.38
SLC6A4 P31645 1/20 0.38
ADRA1A P35348 1/20 0.38
OPRM1 P35372 1/20 0.38
OPRK1 P41145 1/20 0.38
HTR2B P41595 1/20 0.38
KCNQ1 P51787 1/20 0.38

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
SCHEMBL8199247 0.93 AGTR2 (0.42) CHRM2CHRM4CHRM5ADRA2CADRB2
SCHEMBL8209731 0.92 HRH1 (0.39) CHRM2CHRM4CHRM5ADRA2CADRB2
SCHEMBL8205356 0.91 CHIT1 (0.41) CHRM2CHRM4CHRM5ADRA2CADRB2
SCHEMBL8199092 0.91 KMT2A (0.40) CHRM2CHRM4CHRM5ADRA2CADRB2
SCHEMBL8205282 0.90 CHRM3 (0.45) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8206274 0.88 SLC18A3 (0.43) AGTR2SLC18A3L3MBTL1GRIN2BCACNA1C
SCHEMBL8209743 0.88 SLC18A3 (0.43) AGTR2SLC18A3L3MBTL1GRIN2BCACNA1C
SCHEMBL8206075 0.87 CRHBP (0.39) CHRM2CHRM3HTR2AKCNH2SIGMAR1
SCHEMBL8211722 0.87 KDM1A (0.39) DRD2KCNH2L3MBTL1
SCHEMBL8205248 0.87 SLC18A3 (0.45) OPRM1OPRK1AGTR2SLC18A3L3MBTL1

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-0999205-A1 AMINOCYCLOALKANE COMPOUNDS Mitsubishi-Tokyo Pharmaceuticals, Inc. (JP) 2000-05-10 EP disclosed