SCHEMBL9821267

SCHEMBL9821267

CC(Cc1cccc(Oc2cc(Cl)cnc2Cl)c1)CN1CC(C)OC(C)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EBP Q15125 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
ADORA3 P0DMS8 1/20 0.41
CHRM1 P11229 1/20 0.41
DRD3 P35462 1/20 0.41
KCNH2 Q12809 1/20 0.41
MAPK1 P28482 2/20 0.39
ALDH1A1 P00352 4/20 0.36
GAA P10253 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
KDM4E B2RXH2 4/20 0.35
TDP1 Q9NUW8 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
THRB P10828 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
SSTR3 P32745 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
SCHEMBL9810850 0.81 EBP (0.53) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL9810846 0.81 EBP (0.53) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL9164585 0.80 EBP (0.52) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL10593167 0.78 RAB9A (0.48) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL9810872 0.77 EBP (0.51) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL9845765 0.77 EBP (0.51) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL9845798 0.76 LIPE (0.50) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL9167737 0.76 EBP (0.50) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL9164655 0.76 EBP (0.50) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL9162645 0.73 EBP (0.47) EBPSIGMAR1ADORA3CHRM1DRD3

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
JP-3038566-A None JP disclosed
JP-H0338566-A AMINO-ALIPHATIC HETEROCYCLIC PHENYL ETHER AND MICROBICIDE CIBA GEIGY AG 1991-02-19 JP disclosed