SCHEMBL8918733

SCHEMBL8918733

CCc1c(CCN2CCC(c3coc4cc(F)ccc34)CC2)sc2c1CCCNC2=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 12/20 0.38
SLC6A4 P31645 5/20 0.38
HTR2A P28223 7/20 0.37
DRD3 P35462 3/20 0.37
ADRA2A P08913 2/20 0.37
ADRA2B P18089 2/20 0.37
ADRA2C P18825 2/20 0.37
DRD1 P21728 2/20 0.37
DRD4 P21917 2/20 0.37
DRD5 P21918 2/20 0.37
HTR1D P28221 2/20 0.37
HTR1B P28222 2/20 0.37
HTR2C P28335 2/20 0.37
HTR7 P34969 2/20 0.37
ADRA1A P35348 2/20 0.37
HRH1 P35367 2/20 0.37
KCNH2 Q12809 2/20 0.37
SCN5A Q14524 2/20 0.37
ACHE P22303 2/20 0.37
SLC22A2 O15244 1/20 0.37

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
SCHEMBL8916891 0.88 DRD2 (0.38) DRD2SLC6A4HTR2ADRD3ADRA2A
Hydrochloric Acid SCHEMBL8916112 0.87 DRD2 (0.37) DRD2SLC6A4HTR2ADRD3ADRA2A
SCHEMBL8916475 0.83 DRD2 (0.40) DRD2SLC6A4HTR2ADRD3ADRA2A
SCHEMBL8916650 0.80 DRD2 (0.39) DRD2SLC6A4HTR2ADRD3ADRA2A
SCHEMBL8917974 0.79 DRD2 (0.38) DRD2SLC6A4HTR2ADRD3ADRA2A
SCHEMBL8917007 0.79 CTSS (0.46) DRD2SLC6A4HTR2ADRD3HTR7
Hydrochloric Acid SCHEMBL8916924 0.78 CTSS (0.45) DRD2SLC6A4HTR2ADRD3HTR7
SCHEMBL8916164 0.77 CTSS (0.48) DRD2SLC6A4HTR2ADRD3HTR7
Hydrochloric Acid SCHEMBL8918060 0.77 CTSS (0.48) DRD2SLC6A4HTR2ADRD3HTR7
Hydrochloric Acid SCHEMBL8920342 0.77 CTSS (0.49) DRD2SLC6A4HTR2ADRD3HTR1D

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
US-5691330-A ANTIPSYCHOTIC AGENT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-11-25 US disclosed
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US disclosed