SCHEMBL8918089

SCHEMBL8918089

CCc1c(CCN2CCC(c3noc4cc(F)ccc34)CC2)sc2c1CCN(C(C)=O)C2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.54
SLC6A4 P31645 2/20 0.54
HTR2A P28223 10/20 0.53
HTR7 P34969 8/20 0.53
KCNH2 Q12809 8/20 0.53
ACHE P22303 3/20 0.51
DRD3 P35462 2/20 0.51
ABCB11 O95342 1/20 0.51
CHRM2 P08172 1/20 0.51
HTR1A P08908 1/20 0.51
ADRA2A P08913 1/20 0.51
CHRM1 P11229 1/20 0.51
ADRA2B P18089 1/20 0.51
ADRA2C P18825 1/20 0.51
DRD1 P21728 1/20 0.51
DRD4 P21917 1/20 0.51
SLC6A2 P23975 1/20 0.51
HTR2C P28335 1/20 0.51
CCKBR P32239 1/20 0.51
ADRA1A P35348 1/20 0.51

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
SCHEMBL8920271 0.95 DRD2 (0.56) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL8917101 0.94 DRD2 (0.54) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL8918706 0.93 DRD2 (0.56) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL8917038 0.92 HTR2A (0.50) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL8918426 0.92 HTR2A (0.44) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL8917987 0.91 HTR2A (0.49) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL8916632 0.91 DRD2 (0.54) DRD2SLC6A4HTR2AHTR7KCNH2
Fumaric Acid SCHEMBL8991885 0.91 DRD2 (0.51) DRD2SLC6A4HTR2AHTR7KCNH2
Fumaric Acid SCHEMBL8991884 0.91 DRD2 (0.51) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL8918155 0.90 DRD2 (0.53) DRD2SLC6A4HTR2AHTR7KCNH2

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 3 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
EP-0596125-A1 CONDENSED THIOPHENE COMPOUND AND PHARMACEUTICAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-05-11 EP disclosed