SCHEMBL8206446

SCHEMBL8206446

Cc1cccc(CCN(C)C2CCC(C(C(N)=O)(c3ccccc3)c3ccccc3)C2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.38
MEN1 O00255 1/20 0.38
OPRD1 P41143 1/20 0.38
KMT2A Q03164 1/20 0.38
CHRM3 P20309 5/20 0.37
CHRM2 P08172 3/20 0.37
CHRM1 P11229 3/20 0.37
UBE2M P61081 1/20 0.35
DCUN1D1 Q96GG9 1/20 0.35
ACKR3 P25106 3/20 0.34
HTR2A P28223 2/20 0.34
KCNH2 Q12809 2/20 0.34
ADRB2 P07550 1/20 0.34
CHRM4 P08173 1/20 0.34
ADRB1 P08588 1/20 0.34
CHRM5 P08912 1/20 0.34
ADRA2A P08913 1/20 0.34
DRD2 P14416 1/20 0.34
KCNE1 P15382 1/20 0.34
ADRA2B P18089 1/20 0.34

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
SCHEMBL8197961 0.95 OPRM1 (0.38) OPRM1MEN1OPRD1KMT2ACHRM3
SCHEMBL8206406 0.90 UBE2M (0.40) OPRM1MEN1OPRD1KMT2ACHRM3
SCHEMBL8208910 0.86 HSD11B1 (0.46) OPRM1MEN1OPRD1KMT2ACHRM3
SCHEMBL8199247 0.83 AGTR2 (0.42) OPRM1CHRM3CHRM2CHRM1HTR2A
SCHEMBL8209781 0.83 OPRM1 (0.37) OPRM1MEN1OPRD1KMT2ACHRM3
SCHEMBL8209731 0.82 HRH1 (0.39) OPRM1CHRM3CHRM2CHRM1HTR2A
SCHEMBL8206408 0.81 CHRM2 (0.42) OPRM1MEN1OPRD1KMT2ACHRM3
SCHEMBL8199191 0.80 CHRM2 (0.38) OPRM1CHRM3CHRM2CHRM1HTR2A
SCHEMBL8206448 0.80 CHRM2 (0.41) OPRM1MEN1OPRD1KMT2ACHRM3
Hydrochloric Acid SCHEMBL8209836 0.79 AGTR2 (0.47) OPRM1OPRD1OPRK1AGTR2

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