SCHEMBL10694803

SCHEMBL10694803

NCCOc1c2ccc(Cl)cc2cc2cc(Cl)ccc12

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 5/20 0.42
PARP3 Q9Y6F1 5/20 0.42
PLAU P00749 2/20 0.40
CHEK1 O14757 2/20 0.39
HTR1B P28222 1/20 0.36
FERMT2 Q96AC1 3/20 0.36
LOXL2 Q9Y4K0 1/20 0.35
TAAR1 Q96RJ0 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL10695347 0.85 HTR1B (0.47) CHEK1HTR1BFERMT2
SCHEMBL10692973 0.84 S1PR4 (0.34)
SCHEMBL10692528 0.78 MAPT (0.49) HTR1BKDM4E
SCHEMBL10696116 0.78 CHEK1 (0.37) PARP1PARP3PLAUCHEK1HTR1B
SCHEMBL10691905 0.77 L3MBTL1 (0.41) HTR1B
SCHEMBL10695998 0.76 HTR1B (0.56) PLAUHTR1BLOXL2TAAR1KDM4E
SCHEMBL10691402 0.74 LMNA (0.54) HTR1BKDM4E
SCHEMBL10693771 0.73 HTR1B (0.45) CHEK1HTR1BFERMT2
SCHEMBL10692349 0.70 HPGD (0.48)
SCHEMBL10693121 0.69 NCEH1 (0.33)

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