SCHEMBL788025

SCHEMBL788025

COc1ccc(-c2cccc(S(=O)(=O)Nc3cccc(C(=O)O)c3)c2)cc1

nearest known ligand 0.77

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PFKFB3 Q16875 2/20 0.77
POLB P06746 1/20 0.67
MEN1 O00255 4/20 0.64
KMT2A Q03164 4/20 0.64
NPC1 O15118 1/20 0.64
RAB9A P51151 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
TCF4 P15884 1/20 0.63
CTNNB1 P35222 1/20 0.63
ACLY P53396 1/20 0.62
ALDH1A1 P00352 1/20 0.60
PLAU P00749 3/20 0.59
PLAT P00750 1/20 0.59
KAT6A Q92794 1/20 0.57
CYP19A1 P11511 1/20 0.56
AKR1C3 P42330 2/20 0.55

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
SCHEMBL3720429 0.88 TCF4 (0.81) PFKFB3POLBMEN1KMT2ANPC1
SCHEMBL787677 0.88 PFKFB3 (1.00) PFKFB3POLBMEN1KMT2AACLY
SCHEMBL788010 0.84 PFKFB3 (0.83) PFKFB3POLBMEN1KMT2AACLY
SCHEMBL788070 0.84 PFKFB3 (0.83) PFKFB3POLBMEN1KMT2AACLY
SCHEMBL13532190 0.84 MEN1 (0.71) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL788335 0.83 TCF4 (0.66) PFKFB3POLBMEN1KMT2ATCF4
SCHEMBL9997463 0.83 PFKFB3 (0.63) PFKFB3POLBMEN1KMT2AALDH1A1
SCHEMBL30209693 0.81 POLB (0.94) PFKFB3POLBMEN1KMT2AALDH1A1
SCHEMBL2888070 0.81 POLB (0.94) PFKFB3POLBMEN1KMT2AALDH1A1
SCHEMBL788035 0.81 PFKFB3 (0.77) PFKFB3POLBMEN1KMT2AACLY

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
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
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 (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 1/4885POLB 1101/4885MEN1 3253/4885
US-20130172339-A1 SULFONAMIDE COMPOUNDS SULT1A1, STS, ARSA PFKFB3 952/4885POLB 2562/4885MEN1 3971/4885

“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.