SCHEMBL28975397

SCHEMBL28975397

CS(=O)(=O)c1ccc(NN[C@@H](CCC(N)=O)C(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 10/20 0.52
CA1 P00915 8/20 0.52
MMP9 P14780 3/20 0.51
MMP2 P08253 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.44
KMT2A Q03164 1/20 0.43
ITGB1 P05556 1/20 0.39
ITGA4 P13612 1/20 0.39
ACE P12821 1/20 0.39
MMP8 P22894 1/20 0.39
MMP13 P45452 1/20 0.39
ADAMTS4 O75173 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
SCHEMBL28428320 0.83 L3MBTL1 (0.51) CA2CA1MMP9MMP2L3MBTL1
SCHEMBL28432545 0.83 L3MBTL1 (0.51) CA2CA1MMP9MMP2L3MBTL1
SCHEMBL28975401 0.81 KMT2A (0.45) CA2CA1MMP9MMP2L3MBTL1
SCHEMBL28975408 0.81 KMT2A (0.45) CA2CA1MMP9MMP2L3MBTL1
SCHEMBL28424022 0.81 MMP2 (0.46) CA2CA1MMP9MMP2L3MBTL1
SCHEMBL28975407 0.81 MMP2 (0.46) CA2CA1MMP9MMP2L3MBTL1
SCHEMBL28975404 0.81 KMT2A (0.47) CA2CA1MMP9MMP2L3MBTL1
SCHEMBL25212177 0.77 L3MBTL1 (0.51) CA2CA1MMP9MMP2L3MBTL1
SCHEMBL28432542 0.77 KMT2A (0.44) CA2CA1MMP9MMP2L3MBTL1
SCHEMBL28975417 0.77 KMT2A (0.44) CA2CA1MMP9MMP2L3MBTL1

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
CN-111433186-B Glutamic acid derivatives and compositions comprising the same 光州科学技术院 2023-03-31 CN claimed
CN-111433186-B Glutamic acid derivatives and compositions comprising the same 光州科学技术院 2023-03-31 CN disclosed