SCHEMBL7619959

SCHEMBL7619959

COc1ccc(C(NCCC(=O)OC[C@H](N)CO)(c2ccccc2)c2ccc(OC)cc2)cc1.COc1ccc(C(OC[C@@H](CO)NC(=O)CCNC(=O)OCc2ccccc2)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ ATM Q13315 1/20 0.35
▸ GAA P10253 1/20 0.34
▸ CTSL P07711 1/20 0.34
▸ CTSS P25774 1/20 0.34
▸ CTSK P43235 1/20 0.34
▸ KIF11 P52732 3/20 0.34
▸ MAPT P10636 1/20 0.33
▸ CA1 P00915 2/20 0.33
▸ CA2 P00918 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ SLC1A3 P43003 1/20 0.33
▸ SLC1A1 P43005 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ PRSS1 P07477 1/20 0.32
▸ PRSS2 P07478 1/20 0.32
▸ ELANE P08246 1/20 0.32

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
SCHEMBL7616339 0.88 MEN1 (0.44) MEN1KMT2AL3MBTL1ATMGAA
SCHEMBL7615684 0.81 KIF11 (0.49) MEN1KMT2AKIF11MAPTALDH1A1
SCHEMBL13032794 0.76 HDAC6 (0.47) L3MBTL1ATMMAPTHTTCAPN1
SCHEMBL7639356 0.75 MEN1 (0.44) MEN1KMT2AL3MBTL1ATMGAA
SCHEMBL25631518 0.74 KMT2A (0.45) KMT2AL3MBTL1TP53
SCHEMBL7615687 0.74 KIF11 (0.45) KMT2AGAAKIF11ALDH1A1
SCHEMBL6419856 0.74 MEN1 (0.44) MEN1KMT2AL3MBTL1ATMGAA
SCHEMBL7640180 0.73 MEN1 (0.42) MEN1KMT2AL3MBTL1ATMGAA
Succinic Acid SCHEMBL6854675 0.69 KIF11 (0.54) KIF11HTT
SCHEMBL2897015 0.68 KIF11 (0.61) KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1165569-A1 BORONIC ACID CONTAINING REAGENTS AND OLIGONUCLEOTIDES Agilent Technologies, Inc. (US) 2002-01-02 — — EP disclosed
WO-2000056740-A1 BORONIC ACID CONTAINING REAGENTS AND OLIGONUCLEOTIDES PROLINX, INC. (US) 2000-09-28 — — WO disclosed
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