SCHEMBL28804302

SCHEMBL28804302

C=CC(=O)ONC(=O)Nc1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TIMP3 P35625 1/20 0.48
KMT2A Q03164 3/20 0.46
CA12 O43570 9/20 0.45
CA1 P00915 9/20 0.45
CA2 P00918 9/20 0.45
CA9 Q16790 9/20 0.45
TDP1 Q9NUW8 1/20 0.45
TGM2 P21980 3/20 0.44
F13A1 P00488 2/20 0.42
TGM1 P22735 2/20 0.42
CA4 P22748 1/20 0.41
CA7 P43166 1/20 0.41
PTPN7 P35236 1/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL28804177 0.81 MAOA (0.53) KMT2ACA12CA1CA2CA9
SCHEMBL28946875 0.80 EPHX2 (0.47) KMT2ACA12CA1CA2CA9
SCHEMBL28804289 0.78 TIMP3 (0.47) TIMP3KMT2ACA12CA1CA2
SCHEMBL3252353 0.77 NPC1 (0.43) TIMP3CA12CA1CA2CA9
SCHEMBL1815668 0.76 TGM2 (0.72) TGM2F13A1TGM1
Ammonia Solution, Strong SCHEMBL10383894 0.74 TGM2 (0.70) TGM2F13A1TGM1
SCHEMBL3893222 0.74 TGM2 (0.70) TGM2F13A1TGM1
SCHEMBL3460960 0.74 CA12 (0.71) TIMP3KMT2ACA12CA1CA2
SCHEMBL9651525 0.74 TIMP3 (0.58) TIMP3KMT2ACA12CA1CA2
Acrylic Acid SCHEMBL1275501 0.73 CA12 (0.48) TIMP3KMT2ACA12CA1CA2

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
CN-109791361-B Positive lithographic printing plate precursor, method for producing same, and method for producing lithographic printing plate 富士胶片株式会社 2022-06-03 CN disclosed