SCHEMBL9072116

SCHEMBL9072116

CC(C)(C)OC(=O)NNC(=O)c1ccc(O)c(N)c1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.39
▸ GAA P10253 3/20 0.39
▸ GFER P55789 1/20 0.39
▸ MAPT P10636 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ PKM P14618 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ GCGR P47871 1/20 0.39
▸ HDAC1 Q13547 2/20 0.38
▸ STAT3 P40763 2/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.37
▸ MIF P14174 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL10737324 0.87 HDAC6 (0.50) GAAMAPTRECQL
SCHEMBL2835719 0.80 ALDH1A1 (0.45) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL1477613 0.80 MIF (0.50) ALDH1A1GAAGFERMAPTMEN1
SCHEMBL3568864 0.79 ALDH1A1 (0.51) ALDH1A1GAAMAPTKMT2ARECQL
SCHEMBL1121892 0.79 ALOX15 (0.51) ALDH1A1GAAGFERMAPTMEN1
SCHEMBL17680509 0.75 POLB (0.53) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL13605085 0.75 MAPT (0.63) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL19631985 0.75 MAPT (0.49) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL17172491 0.75 ALDH1A1 (0.66) ALDH1A1GAAKMT2AHDAC1TDP1
SCHEMBL23033538 0.75 CA12 (0.48) ALDH1A1GAAGFERMAPTMEN1

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
WO-1999001423-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 1999-01-14 — — WO disclosed
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