SCHEMBL9997091

SCHEMBL9997091

O=C(O)c1ccc(NS(=O)(=O)c2cccc(-c3ccc(Cl)cc3)c2)cc1O

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PFKFB3 Q16875 5/20 0.66
ACLY P53396 5/20 0.60
HPGD P15428 1/20 0.59
HSD17B10 Q99714 1/20 0.59
PGR P06401 1/20 0.56
ALDH1A1 P00352 1/20 0.56
TSHR P16473 1/20 0.56
MCL1 Q07820 1/20 0.55
FLT1 P17948 1/20 0.52
FLT4 P35916 1/20 0.52
KDR P35968 1/20 0.52

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 0.92 PFKFB3 (0.66) PFKFB3ACLYHPGDHSD17B10PGR
SCHEMBL9997986 0.92 PFKFB3 (0.71) PFKFB3ACLYHPGDHSD17B10PGR
SCHEMBL788165 0.91 ALDH1A1 (0.65) PFKFB3ACLYPGRALDH1A1TSHR
SCHEMBL9997327 0.91 PFKFB3 (0.65) PFKFB3ACLYHPGDHSD17B10PGR
SCHEMBL9996882 0.91 PFKFB3 (0.69) PFKFB3ACLYHPGDHSD17B10PGR
SCHEMBL9997099 0.90 PFKFB3 (0.65) PFKFB3ACLYHPGDHSD17B10PGR
SCHEMBL9997213 0.88 PFKFB3 (0.66) PFKFB3ACLYHSD17B10ALDH1A1MCL1
SCHEMBL9997093 0.88 PFKFB3 (0.78) PFKFB3ACLYHSD17B10ALDH1A1MCL1
SCHEMBL9997151 0.87 PFKFB3 (0.65) PFKFB3ACLYHSD17B10ALDH1A1TSHR
SCHEMBL9996789 0.87 PFKFB3 (0.69) PFKFB3ACLYHPGDHSD17B10ALDH1A1

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 5 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
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 1/4885ACLY 61/4885HPGD 980/4885

“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.