SCHEMBL10693568

SCHEMBL10693568

CCNCCCCOc1c2ccccc2cc2c(C)cccc12

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 2/20 0.47
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 1/20 0.46
SCN8A Q9UQD0 12/20 0.43
SLC2A1 P11166 2/20 0.42
SLC6A4 P31645 1/20 0.41
CYP1A2 P05177 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL10692155 0.86 SLC2A1 (0.50) HTR1BALDH1A1KDM4ESLC2A1SLC6A4
SCHEMBL10692922 0.83 HTR1B (0.56) HTR1BSCN8ASLC2A1SLC6A4CYP1A2
SCHEMBL10692538 0.82 ALDH1A1 (0.42) HTR1BALDH1A1KDM4ESCN8ASLC6A4
SCHEMBL10696007 0.81 HTR1B (0.45) HTR1BALDH1A1KDM4ESCN8ASLC6A4
SCHEMBL10692959 0.79 HTR1B (0.56) HTR1BALDH1A1KDM4ECYP1A2HPGD
SCHEMBL8858374 0.79 KDM4E (0.69) ALDH1A1KDM4ESCN8A
SCHEMBL10693962 0.73 HPGD (0.48) ALDH1A1CYP1A2HPGDHSD17B10
SCHEMBL1773810 0.72 HTR1B (0.80) HTR1BALDH1A1KDM4ESLC6A4HPGD
SCHEMBL27603617 0.72 CNR1 (0.41) HTR1BALDH1A1KDM4ESLC2A1CYP1A2
SCHEMBL23089937 0.71 TLR8 (0.46) HTR1BSLC2A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4792551-A 9-anthryloxyaminoalkanes and related compounds as anti-inflammatory and analgetic agents SYNTEX (U.S.A.) INC. (US) 1988-12-20 US disclosed
EP-0132351-A2 9-Anthryloxyaminoalkanes and related compounds, processes for their preparation and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1985-01-30 EP disclosed