SCHEMBL6582162

SCHEMBL6582162

Fc1ccc2c(c1)CC(NC1CCN(c3cccc4c3OCCC4)CC1)C2

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 12/20 0.57
ADRA1D P25100 1/20 0.39
ADRA1A P35348 1/20 0.39
ADRA1B P35368 1/20 0.39
DRD2 P14416 4/20 0.38
HTR2A P28223 4/20 0.38
GPR6 P46095 1/20 0.37
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX12 P18054 1/20 0.36
MAPK1 P28482 1/20 0.36
PMP22 Q01453 1/20 0.36
VCP P55072 1/20 0.35
HTR1D P28221 1/20 0.35
HTR1B P28222 1/20 0.35

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
SCHEMBL6582770 0.94 HTR1A (0.49) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL6585910 0.89 HTR1A (0.47) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL6584899 0.87 HTR1A (0.46) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL6585033 0.87 HTR1A (0.47) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL7481855 0.85 HTR1A (0.68) HTR1AADRA1DADRA1AADRA1B
SCHEMBL7481862 0.85 HTR1A (0.68) HTR1AADRA1DADRA1AADRA1B
SCHEMBL7481799 0.85 HTR1A (0.68) HTR1AADRA1DADRA1AADRA1B
SCHEMBL7481792 0.85 HTR1A (0.68) HTR1AADRA1DADRA1AADRA1B
SCHEMBL6583915 0.85 HTR1A (0.45) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL6584789 0.85 HTR1A (0.56) HTR1AADRA1DADRA1AADRA1BALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0861837-B1 2-Aminoindane derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2004-04-28 EP claimed
CN-1090627-C New 2-amino-1,2-indene compounds, process for their preparation and pharmaceutical compositions containing them SEUER LAB (FR) 2002-09-11 CN claimed
CN-1194983-A New 2-amino-1,2-indene compounds, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1998-10-07 CN claimed
EP-0861837-A1 2-Aminoindane derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1998-09-02 EP claimed
WO-2020183011-A1 HTR1D INHIBITORS AND USES THEREOF IN THE TREATMENT OF CANCER INSTITUT CURIE (FR) 2020-09-17 WO disclosed
EP-0861837-B1 2-Aminoindane derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2004-04-28 EP disclosed
US-5968954-A EXHIBIT SELECTIVE BINDING AFFINITY FOR 5-HYDROXYTRYPTAMINE RECEPTORS ADIR ET COMPAGNIE (FR) 1999-10-19 US disclosed
EP-0861837-A1 2-Aminoindane derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1998-09-02 EP disclosed