SCHEMBL24070387

SCHEMBL24070387

CCC[C@@H](OCCN(C)C)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 3/20 0.36
ADRA2A P08913 3/20 0.36
CHRM1 P11229 3/20 0.36
SLC6A2 P23975 3/20 0.36
SLC6A4 P31645 3/20 0.36
OPRM1 P35372 3/20 0.36
DRD3 P35462 3/20 0.36
SLC6A3 Q01959 3/20 0.36
CYP2D6 P10635 3/20 0.36
LMNA P02545 2/20 0.36
CHRM4 P08173 2/20 0.36
CHRM5 P08912 2/20 0.36
ADRA2B P18089 2/20 0.36
CHRM3 P20309 2/20 0.36
HRH2 P25021 2/20 0.36
HTR2A P28223 2/20 0.36
HTR2C P28335 2/20 0.36
ADRA1A P35348 2/20 0.36
HRH1 P35367 2/20 0.36
HTR2B P41595 2/20 0.36

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
SCHEMBL255537 0.78 CHRM2 (0.38) CHRM2ADRA2ACHRM1SLC6A2SLC6A4
SCHEMBL22021977 0.78 CHRM2 (0.38) CHRM2ADRA2ACHRM1SLC6A2SLC6A4
SCHEMBL7557809 0.76 CHRM2 (0.39) CHRM2ADRA2ACHRM1SLC6A2SLC6A4
SCHEMBL24171153 0.76 CHRM2 (0.39) CHRM2ADRA2ACHRM1SLC6A2SLC6A4
SCHEMBL3973873 0.74 LMNA (0.45) CHRM2ADRA2ACHRM1SLC6A2SLC6A4
SCHEMBL16933982 0.74 TSHR (0.37) LMNATSHRHTT
SCHEMBL24484446 0.74 LMNA (0.42) LMNAHTR2AHRH1
SCHEMBL24070382 0.73 LMNA (0.35) CHRM2ADRA2ACHRM1SLC6A2SLC6A4
SCHEMBL24070375 0.73 LMNA (0.35) CHRM2ADRA2ACHRM1SLC6A2SLC6A4
SCHEMBL23505806 0.72 CHRM2 (0.37) CHRM2ADRA2ACHRM1SLC6A2SLC6A4

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
WO-2021239058-A1 FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF 劲方医药科技(上海)有限公司 2021-12-02 WO disclosed