SCHEMBL9997137

SCHEMBL9997137

O=C(O)c1ccc(NS(=O)(=O)c2cccc(F)c2)cc1O

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PFKFB3 Q16875 5/20 0.75
MCL1 Q07820 1/20 0.60
PGR P06401 1/20 0.55
ALDH1A1 P00352 3/20 0.54
HSD17B10 Q99714 2/20 0.54
MAPT P10636 1/20 0.54
THRB P10828 1/20 0.54
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.52
TSHR P16473 1/20 0.52
HPGD P15428 1/20 0.52
AURKA O14965 1/20 0.52
KDR P35968 1/20 0.52
AURKB Q96GD4 1/20 0.52
ATM Q13315 1/20 0.52
POLB P06746 1/20 0.51
LMNA P02545 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL9997220 0.93 PFKFB3 (0.80) PFKFB3MCL1PGRALDH1A1HSD17B10
SCHEMBL9997093 0.87 PFKFB3 (0.78) PFKFB3MCL1ALDH1A1HSD17B10KMT2A
SCHEMBL9997314 0.87 PFKFB3 (0.74) PFKFB3MCL1ALDH1A1HSD17B10KMT2A
SCHEMBL9997059 0.86 PFKFB3 (0.64) PFKFB3MCL1ALDH1A1HSD17B10KMT2A
SCHEMBL15056348 0.86 PFKFB3 (0.58) PFKFB3MCL1PGRALDH1A1MAPT
SCHEMBL15056118 0.86 PFKFB3 (1.00) PFKFB3MCL1ALDH1A1HSD17B10MAPT
SCHEMBL7828166 0.86 MCL1 (0.78) PFKFB3MCL1ALDH1A1HSD17B10KMT2A
SCHEMBL9997198 0.85 AKR1C3 (0.66) PFKFB3MCL1ALDH1A1HSD17B10MAPT
SCHEMBL9997154 0.85 PFKFB3 (0.82) PFKFB3MCL1ALDH1A1HSD17B10KMT2A
SCHEMBL9997264 0.85 PFKFB3 (0.86) PFKFB3MCL1ALDH1A1HSD17B10KMT2A

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 PFKFB3 1/4885MCL1 1411/4885PGR 3872/4885

“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.