SCHEMBL9527801

SCHEMBL9527801

CCn1cc(C2CCNCC2)c2cc(CCS(N)(=O)=O)ccc21

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.41
HTR1A P08908 3/20 0.37
HTR1D P28221 1/20 0.36
HTR1B P28222 1/20 0.36
KCNH2 Q12809 1/20 0.35
APP P05067 1/20 0.34
SLC6A4 P31645 1/20 0.34
RORC P51449 1/20 0.33
RECQL P46063 1/20 0.32
TP53 P04637 2/20 0.32
DRD2 P14416 1/20 0.32
HTR2C P28335 1/20 0.32
HRH1 P35367 1/20 0.32

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
SCHEMBL9527227 0.87 APP (0.44) HTR6HTR1AHTR1DHTR1BKCNH2
Hydrochloric Acid SCHEMBL9526976 0.86 APP (0.43) HTR6HTR1AHTR1DHTR1BKCNH2
SCHEMBL9526689 0.76 APP (0.42) HTR6HTR1AKCNH2APPRORC
SCHEMBL10123902 0.75 HTR1B (0.63) HTR6HTR1AHTR1DHTR1BSLC6A4
SCHEMBL1823282 0.75 HTR1A (0.49) HTR6HTR1AHTR1DHTR1BSLC6A4
Hydrochloric Acid SCHEMBL3262917 0.74 HTR1A (0.48) HTR6HTR1AHTR1DHTR1BSLC6A4
SCHEMBL8316249 0.72 HTR6 (0.53) HTR6SLC6A4HTR2C
SCHEMBL10691162 0.71 HTR6 (0.57) HTR6HTR2C
SCHEMBL9272212 0.71 HTR1A (0.43) HTR6HTR1AHTR1DHTR1BSLC6A4
Hydrochloric Acid SCHEMBL9274910 0.70 HTR1A (0.42) HTR6HTR1AHTR1DHTR1BSLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1022243-C Indole derivatives and process for preparation thereof GLAXO GROUP LTD (GB) 1993-09-29 CN claimed
EP-0303507-B1 INDOLE DERIVATIVES GLAXO GROUP LTD (GB) 1993-07-28 EP claimed
US-4997841-A Indole derivatives GLAXO GROUP LIMITED (GB) 1991-03-05 US claimed
CN-1038807-A The preparation method of indole derivatives GLAXO GROUP LTD (GB) 1990-01-17 CN claimed
EP-0303506-A2 Indole derivatives GLAXO GROUP LIMITED (GB) 1989-02-15 EP claimed
EP-0303507-A2 Indole derivatives GLAXO GROUP LIMITED (GB) 1989-02-15 EP claimed
CN-1022243-C Indole derivatives and process for preparation thereof GLAXO GROUP LTD (GB) 1993-09-29 CN disclosed
EP-0303507-B1 INDOLE DERIVATIVES GLAXO GROUP LTD (GB) 1993-07-28 EP disclosed
US-4997841-A Indole derivatives GLAXO GROUP LIMITED (GB) 1991-03-05 US disclosed
CN-1038807-A The preparation method of indole derivatives GLAXO GROUP LTD (GB) 1990-01-17 CN disclosed
EP-0303507-A2 Indole derivatives GLAXO GROUP LIMITED (GB) 1989-02-15 EP disclosed