SCHEMBL9997154

SCHEMBL9997154

O=C(O)c1ccc(NS(=O)(=O)c2cccc(-c3ccc(F)cc3F)c2)cc1O

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PFKFB3 Q16875 5/20 0.82
PTGES2 Q9H7Z7 1/20 0.55
MCL1 Q07820 1/20 0.51
FABP4 P15090 3/20 0.51
FABP5 Q01469 2/20 0.51
ALDH1A1 P00352 4/20 0.50
HSD17B10 Q99714 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 1/20 0.50
USP2 O75604 1/20 0.50
DHFR P00374 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
LMNA P02545 1/20 0.50
TTR P02766 1/20 0.50
ALB P02768 1/20 0.50
HMGB1 P09429 1/20 0.50
HPGD P15428 1/20 0.50
CXCL12 P48061 1/20 0.50

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
SCHEMBL9997264 0.92 PFKFB3 (0.86) PFKFB3PTGES2MCL1FABP4FABP5
SCHEMBL15056118 0.90 PFKFB3 (1.00) PFKFB3PTGES2MCL1ALDH1A1HSD17B10
SCHEMBL9997220 0.88 PFKFB3 (0.80) PFKFB3MCL1ALDH1A1HSD17B10MEN1
SCHEMBL9997304 0.87 PFKFB3 (0.75) PFKFB3MCL1FABP4FABP5ALDH1A1
SCHEMBL9997093 0.87 PFKFB3 (0.78) PFKFB3MCL1ALDH1A1HSD17B10MEN1
SCHEMBL9997137 0.85 PFKFB3 (0.75) PFKFB3MCL1ALDH1A1HSD17B10MEN1
SCHEMBL9996992 0.85 PFKFB3 (0.78) PFKFB3PTGES2MCL1FABP4FABP5
SCHEMBL9997314 0.84 PFKFB3 (0.74) PFKFB3PTGES2MCL1ALDH1A1HSD17B10
SCHEMBL9997439 0.84 PFKFB3 (0.71) PFKFB3MCL1FABP4FABP5ALDH1A1
SCHEMBL9997329 0.84 PFKFB3 (0.73) PFKFB3MCL1ALDH1A1HSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 PFKFB3 1/4885PTGES2 894/4885MCL1 1411/4885

“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.