SCHEMBL11019285

SCHEMBL11019285

Cc1cccc(C)c1-c1c(C)cccc1OCCCCCCCN(C)C

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 3/20 0.56
KDM4E B2RXH2 3/20 0.48
HRH1 P35367 1/20 0.48
HTR7 P34969 2/20 0.46
ALDH1A1 P00352 1/20 0.44
THRA P10827 1/20 0.42
THRB P10828 1/20 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
SCHEMBL11022797 0.88 HTR1B (0.55) HTR1BKDM4EHRH1HTR7
SCHEMBL11018350 0.88 KDM4E (0.56) HTR1BKDM4EHRH1HTR7ALDH1A1
SCHEMBL12603016 0.85 HTR1B (0.61) HTR1BKDM4EHRH1HTR7ALDH1A1
SCHEMBL11019533 0.84 KDM4E (0.58) HTR1BKDM4EHRH1HTR7ALDH1A1
SCHEMBL11023153 0.81 ALDH1A1 (0.43) HTR1BKDM4EALDH1A1
SCHEMBL11019776 0.81 HTR1B (0.46) HTR1BKDM4EALDH1A1
SCHEMBL11021382 0.81 HTR1B (0.50) HTR1BKDM4EHRH1HTR7ALDH1A1
SCHEMBL11021244 0.79 KDM4E (0.59) HTR1BKDM4EHRH1HTR7ALDH1A1
SCHEMBL31028996 0.78 HTR1B (0.58) HTR1BKDM4EHRH1ALDH1A1
SCHEMBL13948841 0.78 HRH1 (0.63) HTR1BHRH1HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0157652-A1 2-, 3- And 4-biphenyloxyaminoalkanes and related compounds, their preparation and uses, and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1985-10-09 EP disclosed