SCHEMBL9997485

SCHEMBL9997485

O=C(O)c1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.69
▸ ATM Q13315 1/20 0.65
▸ L3MBTL1 Q9Y468 1/20 0.65
▸ PTPN5 P54829 2/20 0.64
▸ DUSP3 P51452 1/20 0.64
▸ CASP6 P55212 1/20 0.64
▸ PTPN11 Q06124 1/20 0.64
▸ CTDSP1 Q9GZU7 1/20 0.64
▸ ALDH1A1 P00352 5/20 0.62
▸ KMT2A Q03164 4/20 0.62
▸ MEN1 O00255 3/20 0.62
▸ METAP2 P50579 1/20 0.62
▸ MAPT P10636 1/20 0.60
▸ POLB P06746 1/20 0.60
▸ PFKFB3 Q16875 1/20 0.60
▸ HTT P42858 1/20 0.59
▸ LMNA P02545 1/20 0.57
▸ TSHR P16473 1/20 0.57
▸ HSPD1 P10809 1/20 0.56
▸ PTPN2 P17706 1/20 0.56

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
SCHEMBL15055280 0.88 HTT (0.65) GAAATML3MBTL1PTPN5DUSP3
SCHEMBL9997760 0.82 ACLY (0.64) GAAL3MBTL1PTPN5ALDH1A1KMT2A
SCHEMBL11888648 0.81 GAA (0.80) GAAATML3MBTL1PTPN5DUSP3
SCHEMBL21857833 0.79 L3MBTL1 (0.82) GAAATML3MBTL1PTPN5DUSP3
SCHEMBL3899468 0.79 L3MBTL1 (1.00) GAAATML3MBTL1PTPN5DUSP3
SCHEMBL3747313 0.79 L3MBTL1 (0.73) GAAATML3MBTL1CTDSP1ALDH1A1
SCHEMBL1882962 0.79 L3MBTL1 (0.73) GAAATML3MBTL1PTPN5DUSP3
SCHEMBL3746034 0.79 CCKBR (0.74) ATML3MBTL1
SCHEMBL3911114 0.79 L3MBTL1 (0.73) GAAATML3MBTL1PTPN5DUSP3
SCHEMBL3741036 0.79 MEN1 (0.84) GAAATML3MBTL1CTDSP1KMT2A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2794009-B1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER KANCERA AB (SE) 2017-08-30 — — EP claimed
WO-2011161201-A1 BISARYLSULFONAMIDES USEFUL AS KINASE INHIBITORS IN THE TREATMENT OF INFLAMMATION AND CANCER KANCERA AB (SE) 2011-12-29 — — WO claimed
US-20230047816-A1 PFKFB3 INHIBITORS AND THEIR USES GERO PTE. LTD. (SG) 2023-02-16 — — US disclosed
CN-113396145-A PFKFB3 inhibitors and uses thereof 盖罗发现有限责任公司 2021-09-14 — — CN disclosed
WO-2020080979-A1 PFKFB3 INHIBITORS AND THEIR USES GERO DISCOVERY LIMITED LIABILITY COMPANY (RU) 2020-04-23 — — WO disclosed
WO-2011161201-A1 BISARYLSULFONAMIDES USEFUL AS KINASE INHIBITORS IN THE TREATMENT OF INFLAMMATION AND CANCER KANCERA AB (SE) 2011-12-29 — — WO disclosed
WO-2011161201-A1 BISARYLSULFONAMIDES USEFUL AS KINASE INHIBITORS IN THE TREATMENT OF INFLAMMATION AND CANCER KANCERA AB (SE) 2011-12-29 — — WO 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-20230047816-A1 PFKFB3 INHIBITORS AND THEIR USES PFKFB3, PFKFB4, PFKFB1 GAA 2375/4885ATM 1238/4885L3MBTL1 4205/4885

“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.

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