SCHEMBL8370296

SCHEMBL8370296

c1ccc2c(c1)CC(NCCOc1cccc3c1SCCC3)C2

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 3/20 0.47
ADRA2A P08913 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A4 P31645 1/20 0.47
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 2/20 0.43
GRIN2B Q13224 4/20 0.40
SIGMAR1 Q99720 2/20 0.38
DRD2 P14416 3/20 0.37
DRD3 P35462 2/20 0.37
DRD4 P21917 1/20 0.37
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
PRMT5 O14744 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
SCHEMBL8370262 0.96 HTR1A (0.46) HTR1AADRA2ASLC6A2SLC6A4ALDH1A1
SCHEMBL8371192 0.93 HTR1A (0.45) HTR1AADRA2ASLC6A2SLC6A4ALDH1A1
SCHEMBL9124088 0.84 HTR1A (0.52) HTR1AADRA2ASLC6A2SLC6A4ALDH1A1
SCHEMBL8374235 0.84 ALDH1A1 (0.41) HTR1AALDH1A1KDM4EGRIN2BSIGMAR1
SCHEMBL8371183 0.81 GRIN2B (0.44) HTR1AALDH1A1KDM4EGRIN2BSIGMAR1
SCHEMBL8372377 0.80 ALDH1A1 (0.38) HTR1AALDH1A1KDM4EGRIN2BSIGMAR1
SCHEMBL8317904 0.79 HTR1A (0.51) HTR1AADRA2ASLC6A2SLC6A4ALDH1A1
SCHEMBL9120347 0.78 HTR1A (0.66) HTR1AADRA2ASLC6A2SLC6A4ALDH1A1
SCHEMBL8373213 0.77 GRIN2B (0.45) HTR1ASLC6A4ALDH1A1KDM4EGRIN2B
SCHEMBL8371318 0.77 GRIN2B (0.40) HTR1AALDH1A1KDM4EGRIN2BSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0671397-B1 Alkylaminoindane compounds, processes for their preparation and pharmaceutical compositions containing them ADIR (FR) 1999-02-03 EP claimed
US-5569669-A Alkylaminoindane compounds ADIR ET COMPAGNIE (FR) 1996-10-29 US claimed
EP-0671397-A1 Alkylaminoindanes compounds, processes for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1995-09-13 EP claimed
EP-0671397-B1 Alkylaminoindane compounds, processes for their preparation and pharmaceutical compositions containing them ADIR (FR) 1999-02-03 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