SCHEMBL11512131

SCHEMBL11512131

Oc1ccc(NCc2c(O)cc(O)cc2O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.58
▸ L3MBTL1 Q9Y468 6/20 0.48
▸ MEN1 O00255 6/20 0.48
▸ GAA P10253 6/20 0.48
▸ MAPT P10636 6/20 0.48
▸ BLM P54132 6/20 0.48
▸ KMT2A Q03164 6/20 0.48
▸ ALDH1A1 P00352 5/20 0.48
▸ THRB P10828 4/20 0.48
▸ ALOX15 P16050 3/20 0.48
▸ CASP1 P29466 3/20 0.48
▸ HSD17B10 Q99714 3/20 0.48
▸ KDM4E B2RXH2 3/20 0.48
▸ POLB P06746 2/20 0.48
▸ HPGD P15428 2/20 0.48
▸ MAPK1 P28482 2/20 0.48
▸ USP2 O75604 2/20 0.48
▸ PLEC Q15149 2/20 0.48
▸ AGER Q15109 1/20 0.48
▸ HSP90AA1 P07900 1/20 0.48

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
SCHEMBL11510612 0.83 EGFR (0.53) EGFRL3MBTL1MEN1GAAMAPT
SCHEMBL11509476 0.79 MAOB (0.46) EGFRMEN1MAPTKMT2AALDH1A1
SCHEMBL11510302 0.78 EGFR (0.72) EGFRL3MBTL1MEN1GAAMAPT
SCHEMBL10184604 0.77 MEN1 (0.60) EGFRL3MBTL1MEN1GAAMAPT
SCHEMBL9163440 0.73 EGFR (1.00) EGFRMAPTALDH1A1HSP90AA1TDP1
SCHEMBL6795311 0.73 MAPT (0.80) EGFRL3MBTL1MEN1GAAMAPT
SCHEMBL10055010 0.73 MAPT (0.80) EGFRL3MBTL1MEN1GAAMAPT
SCHEMBL11512368 0.72 MAPT (0.59) L3MBTL1MEN1GAAMAPTBLM
SCHEMBL5272368 0.72 BCHE (0.47) EGFRL3MBTL1MEN1GAAMAPT
SCHEMBL10781073 0.69 MAPT (0.73) EGFRL3MBTL1MEN1GAAMAPT

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
US-4152452-A N-BENZYLANILINE AND DERIVATIVES WILLIAM H. RORER, INC. (US) 1979-05-01 — — US disclosed
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