SCHEMBL10694626

SCHEMBL10694626

CCCN(CCC)CCCCCCCCCCOc1c2ccccc2cc2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 4/20 0.49
HTR1D P28221 2/20 0.44
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
ALDH1A1 P00352 2/20 0.42
BCHE P06276 2/20 0.42
ACHE P22303 2/20 0.42

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
SCHEMBL3999665 0.84 TLR8 (0.48) HTR1BALDH1A1
SCHEMBL29371854 0.84 TLR8 (0.48) HTR1BALDH1A1
SCHEMBL29369026 0.84 TLR8 (0.48) HTR1BALDH1A1
SCHEMBL23271667 0.84 TLR8 (0.48) HTR1BALDH1A1
SCHEMBL29368730 0.84 TLR8 (0.48) HTR1BALDH1A1
SCHEMBL23089961 0.84 TLR8 (0.48) HTR1BALDH1A1
SCHEMBL23089944 0.84 TLR8 (0.48) HTR1BALDH1A1
SCHEMBL23089946 0.84 TLR8 (0.48) HTR1BALDH1A1
SCHEMBL10692799 0.83 HTR1B (0.60) HTR1BALDH1A1
SCHEMBL10691295 0.83 HTR1B (0.60) HTR1BALDH1A1

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