SCHEMBL29910097

SCHEMBL29910097

Cn1ncc2cc(NC(=O)OC(C)(C)C)ccc2c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA9 Q16790 1/20 0.48
MAPK14 Q16539 1/20 0.43
PSMB8 P28062 1/20 0.40
NAMPT P43490 1/20 0.40
GSK3B P49841 1/20 0.40
DYRK1A Q13627 1/20 0.40
MAP4K4 O95819 1/20 0.40
ACSS2 Q9NR19 1/20 0.40
MAPKAPK2 P49137 1/20 0.40
RORC P51449 2/20 0.40
RAF1 P04049 1/20 0.39
BRAF P15056 1/20 0.39
CHEK1 O14757 1/20 0.39
FLT3 P36888 1/20 0.39
CYP17A1 P05093 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAOB P27338 1/20 0.39
NOTUM Q6P988 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
SCHEMBL22920024 1.00 CA12 (0.48) CA12CA1CA9MAPK14PSMB8
SCHEMBL16406932 0.84 NOTUM (0.54) CA12CA1CA9MAPK14NAMPT
SCHEMBL28998317 0.81 ACSS2 (0.49) CA12CA1CA9MAPK14NAMPT
SCHEMBL29910103 0.80 CA12 (0.50) CA12CA1CA9MAPK14PSMB8
SCHEMBL29910170 0.77 ROCK2 (0.42) CA12CA1CA9ACSS2
SCHEMBL29195515 0.76 MALT1 (0.43) MAPK14NAMPTGSK3BDYRK1AMAP4K4
SCHEMBL18136169 0.76 ACSS2 (0.44) CA12CA1CA9MAPK14PSMB8
SCHEMBL19879973 0.74 CHEK1 (0.43) RAF1BRAFCHEK1FLT3MAOB
SCHEMBL28087712 0.74 EGFR (0.55) CA12CA1CA9MAPK14NAMPT
SCHEMBL29910123 0.73 KDM4E (0.62) CA12CA1CA9MAPK14PSMB8

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
US-20220289720-A1 ARYL SULFONAMIDES AS SMALL MOLECULE STAT3 INHIBITORS UNIVERSITY OF HAWAII 2022-09-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220289720-A1 ARYL SULFONAMIDES AS SMALL MOLECULE STAT3 INHIBITORS STAT3, JAK2, STAT6 CA12 1524/4885CA1 3831/4885CA9 2147/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.