SCHEMBL8920271

SCHEMBL8920271

CCc1sc2c(c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCN(C(C)=O)C2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 12/20 0.56
SLC6A4 P31645 2/20 0.56
HTR2A P28223 13/20 0.54
HTR7 P34969 10/20 0.54
KCNH2 Q12809 10/20 0.53
ACHE P22303 3/20 0.52
DRD3 P35462 2/20 0.52
HTR1A P08908 2/20 0.52
ADRA2A P08913 2/20 0.52
ADRA1D P25100 2/20 0.52
HTR2C P28335 2/20 0.52
ADRA1A P35348 2/20 0.52
HRH1 P35367 2/20 0.52
ADRA1B P35368 2/20 0.52
HTR6 P50406 2/20 0.52
SLC22A2 O15244 1/20 0.52
CACNA1F O60840 1/20 0.52
ADRB2 P07550 1/20 0.52
CHRM2 P08172 1/20 0.52
CHRM4 P08173 1/20 0.52

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
SCHEMBL8918706 0.96 DRD2 (0.56) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL8918089 0.95 DRD2 (0.54) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL8916147 0.93 DRD2 (0.54) DRD2SLC6A4HTR2AHTR7KCNH2
Fumaric Acid SCHEMBL8991884 0.91 DRD2 (0.51) DRD2SLC6A4HTR2AHTR7KCNH2
Fumaric Acid SCHEMBL8991885 0.91 DRD2 (0.51) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL8916632 0.91 DRD2 (0.54) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL8918155 0.90 DRD2 (0.53) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL8917237 0.90 DRD2 (0.53) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL8917101 0.89 DRD2 (0.54) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL8916687 0.89 DRD2 (0.54) DRD2SLC6A4HTR2AKCNH2ACHE

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