SCHEMBL7524020

SCHEMBL7524020

BrCCOc1cccc2c1SCCC2

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.51
ADRA2A P08913 1/20 0.51
SLC6A2 P23975 1/20 0.51
SLC6A4 P31645 1/20 0.51
HRH3 Q9Y5N1 4/20 0.32
BCL2 P10415 1/20 0.31
BCL2L1 Q07817 1/20 0.31
MCL1 Q07820 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL8372598 0.93 HTR1A (0.50) HTR1AADRA2ASLC6A2SLC6A4HRH3
SCHEMBL8371199 0.91 HTR1A (0.49) HTR1AADRA2ASLC6A2SLC6A4HRH3
SCHEMBL7524469 0.85 HTR1A (0.51) HTR1AADRA2ASLC6A2SLC6A4HRH3
SCHEMBL8317904 0.85 HTR1A (0.51) HTR1AADRA2ASLC6A2SLC6A4HRH3
SCHEMBL9120164 0.82 HTR1A (0.49) HTR1AADRA2ASLC6A2SLC6A4HRH3
SCHEMBL9122214 0.80 HTR1A (0.50) HTR1AADRA2ASLC6A2SLC6A4BCL2
SCHEMBL9123531 0.79 HTR1A (0.49) HTR1AADRA2ASLC6A2SLC6A4BCL2
SCHEMBL9120347 0.78 HTR1A (0.66) HTR1AADRA2ASLC6A2SLC6A4ALDH1A1
SCHEMBL9122514 0.78 HTR1A (0.50) HTR1AADRA2ASLC6A2SLC6A4
SCHEMBL7524073 0.76 HTR1A (0.52) HTR1AADRA2ASLC6A2SLC6A4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0873993-B1 Heterocyclic compounds, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2002-02-20 EP disclosed
US-5919814-A Heterocyclic compounds ADIR ET COMPAGNIE (FR) 1999-07-06 US disclosed
EP-0671397-B1 Alkylaminoindane compounds, processes for their preparation and pharmaceutical compositions containing them ADIR (FR) 1999-02-03 EP disclosed
EP-0873993-A1 Heterocyclic compounds, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1998-10-28 EP disclosed
US-5569669-A Alkylaminoindane compounds ADIR ET COMPAGNIE (FR) 1996-10-29 US disclosed
EP-0671397-A1 Alkylaminoindanes compounds, processes for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1995-09-13 EP disclosed
US-5389668-A Thiochroman compounds ADIR ET COMPAGNIE (FR) 1995-02-14 US disclosed
US-5385930-A Treating central nervous system disorders like anxiety and depression ADIR ET COMPAGNIE (FR) 1995-01-31 US disclosed
US-5371103-A Thiochroman compounds ADIR ET COMPAGNIE (FR) 1994-12-06 US disclosed