SCHEMBL8917237

SCHEMBL8917237

CC(=O)c1c(CCN2CCC(c3noc4cc(F)ccc34)CC2)sc2c1CCN(C(C)=O)C2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.53
HTR2A P28223 4/20 0.53
ACHE P22303 3/20 0.53
SLC6A4 P31645 2/20 0.53
DRD3 P35462 2/20 0.53
HTR1A P08908 2/20 0.53
ADRA2A P08913 2/20 0.53
HTR2C P28335 2/20 0.53
ADRA1A P35348 2/20 0.53
HRH1 P35367 2/20 0.53
HTR6 P50406 2/20 0.53
KCNH2 Q12809 2/20 0.53
ABCB11 O95342 1/20 0.53
CHRM2 P08172 1/20 0.53
CHRM1 P11229 1/20 0.53
ADRA2B P18089 1/20 0.53
ADRA2C P18825 1/20 0.53
DRD1 P21728 1/20 0.53
DRD4 P21917 1/20 0.53
SLC6A2 P23975 1/20 0.53

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
SCHEMBL8916632 0.92 DRD2 (0.54) DRD2HTR2AACHESLC6A4DRD3
SCHEMBL8918155 0.91 DRD2 (0.53) DRD2HTR2AACHESLC6A4DRD3
SCHEMBL8918089 0.90 DRD2 (0.54) DRD2HTR2AACHESLC6A4DRD3
SCHEMBL8920271 0.90 DRD2 (0.56) DRD2HTR2AACHESLC6A4DRD3
SCHEMBL8918706 0.88 DRD2 (0.56) DRD2HTR2AACHESLC6A4DRD3
SCHEMBL8916147 0.88 DRD2 (0.54) DRD2HTR2AACHESLC6A4DRD3
SCHEMBL8920652 0.87 DRD2 (0.53) DRD2HTR2ASLC6A4DRD3HTR1A
Oxalic Acid SCHEMBL8917876 0.86 HTR2A (0.51) DRD2HTR2ASLC6A4KCNH2HTR7
SCHEMBL8917880 0.86 DRD2 (0.53) DRD2HTR2AACHESLC6A4DRD3
Fumaric Acid SCHEMBL8991885 0.86 DRD2 (0.51) DRD2HTR2AACHESLC6A4DRD3

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