SCHEMBL793719

SCHEMBL793719

Cc1c(S(=O)(=O)Nc2cccc(-c3nnn[nH]3)c2)oc2ccc(C(C)C)cc12

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PFKFB3 Q16875 11/20 0.72
PFKFB4 Q16877 5/20 0.47
SMN1; SMN2 Q16637 1/20 0.41
TP53 P04637 2/20 0.37
MAPT P10636 1/20 0.37
HTR6 P50406 1/20 0.36
MAP2K4 P45985 1/20 0.35
KIT P10721 1/20 0.34

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
SCHEMBL21857714 0.84 PFKFB3 (1.00) PFKFB3PFKFB4
SCHEMBL794120 0.81 PFKFB3 (0.71) PFKFB3PFKFB4
SCHEMBL788018 0.76 PFKFB3 (1.00) PFKFB3PFKFB4SMN1; SMN2
SCHEMBL788388 0.74 PFKFB3 (0.81) PFKFB3PFKFB4SMN1; SMN2TP53MAPT
SCHEMBL793762 0.70 PFKFB3 (0.47) PFKFB3TP53MAPT
SCHEMBL793671 0.70 PFKFB3 (0.68) PFKFB3PFKFB4
SCHEMBL27943370 0.70 MMP2 (0.59) PFKFB3PFKFB4TP53MAPTHTR6
SCHEMBL793699 0.70 CCR2 (0.41) PFKFB3
SCHEMBL9997233 0.69 PFKFB3 (0.70) PFKFB3PFKFB4SMN1; SMN2TP53MAPT
SCHEMBL12545623 0.69 RXRA (0.41) SMN1; SMN2TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9233946-B2 Sulfonamide compounds KANCERA AB (SE) 2016-01-12 US claimed
EP-2616450-A2 SULFONAMIDE COMPOUNDS Kancera AB (SE) 2013-07-24 EP claimed
US-20130172339-A1 SULFONAMIDE COMPOUNDS KANCERA AB (SE) 2013-07-04 US claimed
WO-2012035171-A2 NEW COMPOUNDS KANCERA AB (SE) 2012-03-22 WO claimed
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
US-9233946-B2 Sulfonamide compounds KANCERA AB (SE) 2016-01-12 US disclosed
US-9233946-B2 Sulfonamide compounds KANCERA AB (SE) 2016-01-12 US disclosed
US-20130172339-A1 SULFONAMIDE COMPOUNDS KANCERA AB (SE) 2013-07-04 US disclosed
US-20130172339-A1 SULFONAMIDE COMPOUNDS KANCERA AB (SE) 2013-07-04 US disclosed
WO-2012035171-A2 NEW COMPOUNDS KANCERA AB (SE) 2012-03-22 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-20130172339-A1 SULFONAMIDE COMPOUNDS SULT1A1, STS, ARSA PFKFB3 952/4885PFKFB4 889/4885SMN1; SMN2 2430/4885

“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.