SCHEMBL1647356

SCHEMBL1647356

COc1cccc2c1C(=O)c1c(cccc1OC)C2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.52
ALDH1A1 P00352 5/20 0.52
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
USP2 O75604 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
CYP3A4 P08684 2/20 0.52
HPN P05981 1/20 0.52
ALOX5 P09917 1/20 0.52
THRB P10828 1/20 0.52
ALOX15 P16050 1/20 0.52
TSHR P16473 1/20 0.52
PTGS1 P23219 1/20 0.52
PDE4A P27815 1/20 0.52
KDR P35968 1/20 0.52
HSD17B10 Q99714 1/20 0.52
SIRT5 Q9NXA8 1/20 0.52
HRH3 Q9Y5N1 1/20 0.52
EGFR P00533 1/20 0.50

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
SCHEMBL12775753 0.90 ALDH1A1 (0.71) MAPTALDH1A1MEN1KMT2AUSP2
SCHEMBL6906412 0.88 ALDH1A1 (0.58) MAPTALDH1A1MEN1KMT2AUSP2
SCHEMBL23666810 0.85 ACHE (0.43) MAPTALDH1A1MEN1KMT2AUSP2
SCHEMBL2047592 0.84 TOP1 (0.47) MAPTALDH1A1MEN1KMT2AUSP2
SCHEMBL13839587 0.84 MEN1 (0.41) MAPTALDH1A1MEN1KMT2AUSP2
SCHEMBL23649700 0.81 ALDH1A1 (0.50) MAPTALDH1A1MEN1KMT2AUSP2
SCHEMBL23649698 0.81 ALDH1A1 (0.50) MAPTALDH1A1MEN1KMT2AUSP2
SCHEMBL30040953 0.81 ALDH1A1 (0.50) MAPTALDH1A1MEN1KMT2AUSP2
SCHEMBL7604955 0.79 CA9 (0.43) MAPTALDH1A1MEN1KMT2AUSP2
SCHEMBL20796438 0.79 MEN1 (0.55) MAPTALDH1A1MEN1KMT2AUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011045404-A2 COMPOSITION COMPRISING AT LEAST ONE ANTHRONE DERIVATIVE AND ONE BASIFYING AGENT, AND METHOD FOR DYEING KERATINOUS FIBRES STARTING FROM THE COMPOSITION L'OREAL (FR) 2011-04-21 WO disclosed
WO-2011045404-A2 COMPOSITION COMPRISING AT LEAST ONE ANTHRONE DERIVATIVE AND ONE BASIFYING AGENT, AND METHOD FOR DYEING KERATINOUS FIBRES STARTING FROM THE COMPOSITION L'OREAL (FR) 2011-04-21 WO disclosed
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