SCHEMBL8917275

SCHEMBL8917275

CC(=O)N1CCc2cc(C(=O)CN3CCC(c4noc5cc(F)ccc45)CC3)sc2C1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.51
SLC6A4 P31645 1/20 0.51
HTR2A P28223 6/20 0.50
HTR7 P34969 4/20 0.50
DRD3 P35462 2/20 0.49
ACHE P22303 1/20 0.49
KCNH2 Q12809 4/20 0.49
HTR1A P08908 2/20 0.49
HTR6 P50406 2/20 0.49
ADRA2A P08913 1/20 0.49
ADRA1D P25100 1/20 0.49
HTR2C P28335 1/20 0.49
ADRA1A P35348 1/20 0.49
HRH1 P35367 1/20 0.49
ADRA1B P35368 1/20 0.49
MCHR1 Q99705 1/20 0.49

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
Hydrochloric Acid SCHEMBL8917151 0.92 MCHR1 (0.54) DRD2SLC6A4HTR2AHTR7DRD3
SCHEMBL8918296 0.91 MCHR1 (0.62) DRD2HTR2AHTR7DRD3KCNH2
SCHEMBL8917299 0.86 DRD2 (0.56) DRD2SLC6A4HTR2AHTR7DRD3
Hydrochloric Acid SCHEMBL8991890 0.86 MCHR1 (0.56) DRD2HTR2AHTR7DRD3KCNH2
SCHEMBL8916168 0.85 DRD2 (0.50) DRD2SLC6A4HTR2AHTR7DRD3
SCHEMBL8917663 0.85 MCHR1 (0.62) DRD2SLC6A4HTR2ADRD3KCNH2
Oxalic Acid SCHEMBL8917846 0.83 DRD2 (0.54) DRD2SLC6A4HTR2ADRD3ACHE
SCHEMBL8917984 0.82 HTR2A (0.55) DRD2SLC6A4HTR2AHTR7DRD3
Hydrochloric Acid SCHEMBL8991836 0.81 HTR2A (0.55) DRD2SLC6A4HTR2AHTR7DRD3
SCHEMBL8917083 0.80 ACHE (0.50) DRD2SLC6A4HTR2AHTR7DRD3

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