SCHEMBL8916168

SCHEMBL8916168

CC(=O)N1CCc2c(sc(C)c2C(=O)CN2CCC(c3noc4cc(F)ccc34)CC2)C1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.50
HTR2A P28223 5/20 0.50
HTR7 P34969 3/20 0.50
KCNH2 Q12809 3/20 0.50
SLC6A4 P31645 1/20 0.50
DRD3 P35462 1/20 0.49
ACHE P22303 1/20 0.49
HTR1A P08908 1/20 0.48
ADRA2A P08913 1/20 0.48
ADRA1D P25100 1/20 0.48
HTR2C P28335 1/20 0.48
ADRA1A P35348 1/20 0.48
HRH1 P35367 1/20 0.48
ADRA1B P35368 1/20 0.48
HTR6 P50406 1/20 0.48

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
SCHEMBL8917880 0.92 DRD2 (0.53) DRD2HTR2AHTR7KCNH2SLC6A4
SCHEMBL8916453 0.91 DRD2 (0.54) DRD2HTR2AKCNH2SLC6A4DRD3
SCHEMBL8916147 0.86 DRD2 (0.54) DRD2HTR2AHTR7KCNH2SLC6A4
SCHEMBL8917275 0.85 DRD2 (0.51) DRD2HTR2AHTR7KCNH2SLC6A4
SCHEMBL8918298 0.85 DRD2 (0.54) DRD2HTR2AHTR7KCNH2SLC6A4
SCHEMBL8916687 0.85 DRD2 (0.54) DRD2HTR2AKCNH2SLC6A4DRD3
SCHEMBL8917237 0.85 DRD2 (0.53) DRD2HTR2AHTR7KCNH2SLC6A4
SCHEMBL8916632 0.84 DRD2 (0.54) DRD2HTR2AHTR7KCNH2SLC6A4
SCHEMBL8920652 0.84 DRD2 (0.53) DRD2HTR2AHTR7KCNH2SLC6A4
SCHEMBL8920271 0.82 DRD2 (0.56) DRD2HTR2AHTR7KCNH2SLC6A4

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