SCHEMBL11225104

SCHEMBL11225104

CCN1CCN(C(=O)NCC(=O)O)C(=O)C1=O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ POLB P06746 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ RBP4 P02753 1/20 0.35
▸ INMT O95050 1/20 0.33
▸ EGLN1 Q9GZT9 4/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ITGB1 P05556 1/20 0.31
▸ ITGA5 P08648 1/20 0.31
▸ APEX1 P27695 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ BBOX1 O75936 1/20 0.31
▸ ASPH Q12797 1/20 0.31
▸ KDM8 Q8N371 1/20 0.31
▸ HIF1AN Q9NWT6 1/20 0.31
▸ ACE P12821 1/20 0.30

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
SCHEMBL10402214 0.83 GAA (0.40) GAAL3MBTL1HDAC1HDAC2POLB
SCHEMBL11225425 0.82 GAA (0.43) GAAL3MBTL1HDAC1HDAC2POLB
SCHEMBL10404631 0.82 GAA (0.39) GAAL3MBTL1HDAC1HDAC2POLB
SCHEMBL10540459 0.81 GAA (0.42) GAAL3MBTL1HDAC1HDAC2POLB
SCHEMBL9328091 0.79 GAA (0.45) GAAL3MBTL1HDAC1HDAC2POLB
SCHEMBL10644092 0.79 HDAC1 (0.37) GAAL3MBTL1HDAC1HDAC2POLB
SCHEMBL22515644 0.78 KDM4E (0.57) GAAHDAC1HDAC2KMT2AITGB1
SCHEMBL24044262 0.76 GAA (0.42) GAAL3MBTL1HDAC1HDAC2POLB
SCHEMBL14866125 0.75 GAA (0.47) GAAL3MBTL1HDAC1HDAC2POLB
SCHEMBL11185389 0.75 GAA (0.40) GAAL3MBTL1HDAC1HDAC2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4416817-A BACTERICIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1983-11-22 — — US disclosed
EP-0021676-B1 3-METHOXY-2-OXOAZETIDINE DERIVATIVES AND THEIR PRODUCTION Takeda Chemical Industries, Ltd. (JP) 1983-09-14 — — EP disclosed
EP-0021676-A1 3-Methoxy-2-oxoazetidine derivatives and their production Takeda Chemical Industries, Ltd. (JP) 1981-01-07 — — EP disclosed
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