SCHEMBL9997096

SCHEMBL9997096

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

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.69
TSHR P16473 1/20 0.69
HSD17B10 Q99714 2/20 0.65
HPGD P15428 1/20 0.65
PFKFB3 Q16875 4/20 0.61
PGR P06401 8/20 0.61
MCL1 Q07820 1/20 0.60
ACLY P53396 1/20 0.59
PKM P14618 1/20 0.58
LMNA P02545 1/20 0.53
MAPT P10636 1/20 0.53
TDP1 Q9NUW8 1/20 0.53

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
SCHEMBL9997323 0.93 PFKFB3 (0.66) ALDH1A1TSHRHSD17B10HPGDPFKFB3
SCHEMBL9997206 0.88 HSD17B10 (0.66) ALDH1A1TSHRHSD17B10HPGDPFKFB3
SCHEMBL9997327 0.87 PFKFB3 (0.65) ALDH1A1TSHRHSD17B10HPGDPFKFB3
SCHEMBL9997091 0.87 PFKFB3 (0.66) ALDH1A1TSHRHSD17B10HPGDPFKFB3
SCHEMBL9997059 0.86 PFKFB3 (0.64) ALDH1A1TSHRHSD17B10HPGDPFKFB3
SCHEMBL15055005 0.86 MAPT (0.61) ALDH1A1TSHRPGRPKMLMNA
SCHEMBL7828166 0.86 MCL1 (0.78) ALDH1A1TSHRHSD17B10HPGDPFKFB3
SCHEMBL9997198 0.85 AKR1C3 (0.66) ALDH1A1TSHRHSD17B10PFKFB3MCL1
SCHEMBL9997160 0.85 HSD17B10 (0.70) ALDH1A1TSHRHSD17B10HPGDPFKFB3
SCHEMBL9997289 0.84 PFKFB3 (0.61) ALDH1A1TSHRHSD17B10HPGDPFKFB3

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 ALDH1A1 1943/4885TSHR 4576/4885HSD17B10 1255/4885

“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.