SCHEMBL28655580

SCHEMBL28655580

CC(CCNC(=O)OC(C)(C)C)S(=O)(=O)O

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.56
MEN1 O00255 1/20 0.53
GAA P10253 1/20 0.53
KMT2A Q03164 1/20 0.53
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
CA1 P00915 11/20 0.43
CA2 P00918 11/20 0.43
CA12 O43570 8/20 0.43
CA9 Q16790 7/20 0.43
MALT1 Q9UDY8 1/20 0.41
EPHX1 P07099 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA7 P43166 1/20 0.39
KCNA5 P22460 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
SCHEMBL28219956 0.81 MEN1 (0.57) TDP1MEN1GAAKMT2AMAOA
SCHEMBL1654204 0.81 MEN1 (0.57) TDP1MEN1GAAKMT2AMAOA
SCHEMBL22772909 0.81 MEN1 (0.50) TDP1MEN1GAAKMT2AMAOA
SCHEMBL397759 0.80 MEN1 (0.61) TDP1MEN1GAAKMT2AMAOA
SCHEMBL5019056 0.79 MEN1 (0.59) TDP1MEN1GAAKMT2AMAOA
SCHEMBL5761580 0.79 MEN1 (0.59) TDP1MEN1GAAKMT2AMAOA
SCHEMBL12598786 0.79 MEN1 (0.59) TDP1MEN1GAAKMT2AMAOA
SCHEMBL2368382 0.79 MEN1 (0.59) TDP1MEN1GAAKMT2AMAOA
SCHEMBL26498427 0.78 MEN1 (0.58) TDP1MEN1GAAKMT2AMAOA
SCHEMBL22237526 0.77 MEN1 (0.57) TDP1MEN1GAAKMT2AMAOA

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-109956957-B Imidazo [1,2-b ] pyridazine large-ring kinase inhibitor 广州白云山医药集团股份有限公司白云山制药总厂 2021-11-09 CN disclosed