SCHEMBL8918296

SCHEMBL8918296

CC(=O)N1CCc2cc(C(=O)CCCN3CCC(c4noc5cc(F)ccc45)CC3)sc2C1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.62
HTR1A P08908 5/20 0.58
DRD2 P14416 5/20 0.58
HTR2A P28223 5/20 0.58
HTR6 P50406 4/20 0.58
KCNH2 Q12809 4/20 0.58
HTR2C P28335 3/20 0.58
HRH1 P35367 3/20 0.58
DRD3 P35462 3/20 0.58
ADRA1A P35348 2/20 0.58
DRD1 P21728 1/20 0.56
ADRA2A P08913 1/20 0.54
ADRA1D P25100 1/20 0.54
ADRA1B P35368 1/20 0.54
HTR7 P34969 1/20 0.54

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 SCHEMBL8991890 0.95 MCHR1 (0.56) MCHR1HTR1ADRD2HTR2AHTR6
Hydrochloric Acid SCHEMBL8917151 0.95 MCHR1 (0.54) MCHR1HTR1ADRD2HTR2AHTR6
SCHEMBL8917663 0.94 MCHR1 (0.62) MCHR1HTR1ADRD2HTR2AHTR6
SCHEMBL8917275 0.91 DRD2 (0.51) MCHR1HTR1ADRD2HTR2AHTR6
SCHEMBL8917299 0.87 DRD2 (0.56) HTR1ADRD2HTR2AHTR6KCNH2
Oxalic Acid SCHEMBL8917846 0.87 DRD2 (0.54) HTR1ADRD2HTR2AHTR6KCNH2
SCHEMBL8916453 0.86 DRD2 (0.54) HTR1ADRD2HTR2AHTR6KCNH2
SCHEMBL8920652 0.85 DRD2 (0.53) HTR1ADRD2HTR2AHTR6KCNH2
SCHEMBL8918298 0.84 DRD2 (0.54) HTR1ADRD2HTR2AHTR6KCNH2
SCHEMBL8917984 0.82 HTR2A (0.55) HTR1ADRD2HTR2AHTR6KCNH2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0596125-A1 CONDENSED THIOPHENE COMPOUND AND PHARMACEUTICAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-05-11 EP claimed
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
EP-0596125-A1 CONDENSED THIOPHENE COMPOUND AND PHARMACEUTICAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-05-11 EP disclosed