SCHEMBL28804289

SCHEMBL28804289

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

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TIMP3 P35625 1/20 0.47
KMT2A Q03164 2/20 0.45
CA12 O43570 11/20 0.44
CA1 P00915 11/20 0.44
CA2 P00918 11/20 0.44
CA9 Q16790 11/20 0.44
PTPN7 P35236 1/20 0.43

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
SCHEMBL28804383 0.89 KMT2A (0.61) KMT2ACA12CA1CA2CA9
SCHEMBL28804280 0.82 MAOA (0.51) KMT2ACA12CA1CA2CA9
SCHEMBL28804386 0.82 RAB9A (0.50) PTPN7
SCHEMBL28804345 0.82 SMN1; SMN2 (0.53) KMT2ACA12CA1CA2CA9
SCHEMBL28804161 0.81 EPHX2 (0.50) KMT2ACA12CA1CA2CA9
SCHEMBL28804302 0.78 TIMP3 (0.48) TIMP3KMT2ACA12CA1CA2
SCHEMBL3256209 0.78 CA2 (0.42) TIMP3CA12CA1CA2CA9
SCHEMBL28804153 0.77 RAB9A (0.39) KMT2ACA12CA1CA2CA9
SCHEMBL691748 0.77 RXFP1 (0.57) TIMP3KMT2ACA12CA1CA2
SCHEMBL3463278 0.75 RXFP1 (0.56) 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