SCHEMBL11214518

SCHEMBL11214518

COC(=O)Cc1cc(OC)cc(N)c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.46
▸ GAA P10253 4/20 0.46
▸ GFER P55789 1/20 0.46
▸ HSP90AB1 P08238 1/20 0.42
▸ KDM4E B2RXH2 5/20 0.42
▸ HPGD P15428 1/20 0.42
▸ MAPT P10636 2/20 0.41
▸ RECQL P46063 2/20 0.41
▸ POLB P06746 2/20 0.41
▸ ABL1 P00519 1/20 0.41
▸ RIN1 Q13671 1/20 0.41
▸ CTDSP1 Q9GZU7 1/20 0.41
▸ BACE1 P56817 1/20 0.40
▸ KMT2A Q03164 4/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ THRB P10828 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ MCL1 Q07820 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL11213302 0.86 SMN1; SMN2 (0.43) ALDH1A1GAAKDM4EHPGDMAPT
SCHEMBL10268696 0.85 ALDH1A1 (0.44) ALDH1A1GAAGFERHSP90AB1KDM4E
SCHEMBL11212844 0.84 POLB (0.40) ALDH1A1GAAGFERKDM4EMAPT
SCHEMBL4970416 0.78 ALDH1A1 (0.44) ALDH1A1GAAKDM4EMAPTRECQL
SCHEMBL11210532 0.75 CYP4F2 (0.44) ALDH1A1GAAKDM4EHPGDMAPT
SCHEMBL12270110 0.74 ALDH1A1 (0.56) ALDH1A1GAAGFERKDM4EHPGD
SCHEMBL5093783 0.74 ALDH1A1 (0.67) ALDH1A1GAAGFERHSP90AB1KDM4E
SCHEMBL29749375 0.73 ALDH1A1 (0.49) ALDH1A1GAAGFERHSP90AB1KDM4E
SCHEMBL10268521 0.73 ALDH1A1 (0.49) ALDH1A1GAAGFERHSP90AB1KDM4E
SCHEMBL4034916 0.73 MTNR1A (0.56) ALDH1A1GAAGFERKDM4EHPGD

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-0081321-A1 2-Aminophenol derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1983-06-15 — — EP disclosed
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