SCHEMBL788388

SCHEMBL788388

COC(=O)c1cccc(NS(=O)(=O)c2oc3ccc(C(C)C)cc3c2C)c1

nearest known ligand 0.81

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PFKFB3 Q16875 10/20 0.81
PFKFB4 Q16877 7/20 0.65
TCF4 P15884 2/20 0.51
CTNNB1 P35222 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.48
POLB P06746 1/20 0.48
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
PTPN1 P18031 2/20 0.43
HSPD1 P10809 1/20 0.43
PTPN2 P17706 1/20 0.43
PTPN5 P54829 1/20 0.43
HSPE1 P61604 1/20 0.43
PTPN6 P29350 1/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL788018 0.90 PFKFB3 (1.00) PFKFB3PFKFB4SMN1; SMN2POLBPTPN1
SCHEMBL15079625 0.83 PFKFB3 (0.62) PFKFB3PFKFB4SMN1; SMN2POLBTP53
SCHEMBL788389 0.82 PFKFB3 (0.56) PFKFB3PFKFB4TCF4CTNNB1SMN1; SMN2
SCHEMBL787888 0.79 PFKFB3 (1.00) PFKFB3PFKFB4
SCHEMBL9997233 0.77 PFKFB3 (0.70) PFKFB3PFKFB4SMN1; SMN2POLBTP53
SCHEMBL21857714 0.76 PFKFB3 (1.00) PFKFB3PFKFB4
SCHEMBL793719 0.74 PFKFB3 (0.72) PFKFB3PFKFB4SMN1; SMN2TP53MAPT
SCHEMBL788583 0.71 PFKFB3 (0.56) PFKFB3SMN1; SMN2PTPN1MEN1KMT2A
SCHEMBL31317790 0.71 POLB (0.70) PFKFB3PFKFB4TCF4CTNNB1SMN1; SMN2
SCHEMBL4191490 0.71 POLB (0.70) PFKFB3PFKFB4TCF4CTNNB1SMN1; SMN2

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 14 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
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
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
EP-2616450-A2 SULFONAMIDE COMPOUNDS Kancera AB (SE) 2013-07-24 EP 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
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 (2 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 1/4885PFKFB4 2/4885TCF4 1410/4885
US-20130172339-A1 SULFONAMIDE COMPOUNDS SULT1A1, STS, ARSA PFKFB3 952/4885PFKFB4 889/4885TCF4 1649/4885

“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.