SCHEMBL9520859

SCHEMBL9520859

c1ccc2c(N3CCN(CCc4ccc(-c5csnn5)cc4)CC3)nsc2c1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.60
HTR7 P34969 2/20 0.60
HTR2A P28223 6/20 0.53
DRD2 P14416 4/20 0.53
KCNH2 Q12809 2/20 0.53
ADRA1D P25100 2/20 0.51
ADRA1B P35368 2/20 0.51
DRD3 P35462 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
SCHEMBL9519254 0.93 HTR2A (0.56) HTR1AHTR7HTR2ADRD2KCNH2
SCHEMBL9520828 0.83 HTR1A (0.59) HTR1AHTR7HTR2ADRD2KCNH2
SCHEMBL10845693 0.82 HTR1A (0.72) HTR1AHTR7HTR2ADRD2KCNH2
SCHEMBL9519431 0.82 HTR1A (0.58) HTR1AHTR7HTR2ADRD2KCNH2
SCHEMBL6105283 0.80 HTR1A (0.70) HTR1AHTR7HTR2ADRD2KCNH2
SCHEMBL9519161 0.79 HTR1A (0.55) HTR1AHTR2ADRD2ADRA1DADRA1B
SCHEMBL9519156 0.78 HTR1A (0.58) HTR1AHTR7HTR2ADRD2KCNH2
SCHEMBL9521839 0.77 HTR2A (0.69) HTR1AHTR7HTR2ADRD2ADRA1D
SCHEMBL6105280 0.76 HTR1A (0.64) HTR1AHTR7HTR2ADRD2KCNH2
SCHEMBL6104704 0.76 HTR1A (0.64) HTR1AHTR7HTR2ADRD2KCNH2

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
EP-0279598-B1 ARYLPIPERAZINYL-ALKYLENE-PHENYL-HETEROCYCLIC COMPOUNDS PFIZER INC. (US) 1993-09-15 EP disclosed
US-4891375-A Arylpiperazinyl-alkylene-phenyl-heterocyclic compounds PFIZER INC. (US) 1990-01-02 US disclosed
EP-0279598-A2 Arylpiperazinyl-alkylene-phenyl-heterocyclic compounds PFIZER INC. (US) 1988-08-24 EP disclosed