SCHEMBL787595

SCHEMBL787595

CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C(F)(F)F)on3)ccc2CC)c1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.51
LMNA P02545 5/20 0.49
TP53 P04637 3/20 0.49
POLB P06746 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
IDH1 O75874 1/20 0.43
SYK P43405 1/20 0.42

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
SCHEMBL788475 0.83 MAPT (0.48) MAPTLMNATP53POLBSMN1; SMN2
SCHEMBL787882 0.82 PFKFB3 (0.54) MAPTLMNATP53POLBSMN1; SMN2
SCHEMBL787806 0.81 MAPT (0.62) MAPTLMNATP53POLB
SCHEMBL3250576 0.77 PDK2 (0.47) MAPTLMNASMN1; SMN2
SCHEMBL793716 0.74 LMNA (0.61) MAPTLMNATP53POLBSMN1; SMN2
SCHEMBL794013 0.72 POLB (0.61) MAPTLMNATP53POLBSMN1; SMN2
SCHEMBL788350 0.72 TP53 (0.55) MAPTLMNATP53POLB
SCHEMBL787810 0.71 LMNA (0.58) MAPTLMNATP53POLBSMN1; SMN2
SCHEMBL17343057 0.71 TSHR (0.62) MAPTLMNATP53POLBSMN1; SMN2
SCHEMBL5245085 0.71 ALDH1A1 (0.58) MAPTLMNAPOLBSMN1; 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230047816-A1 PFKFB3 INHIBITORS AND THEIR USES GERO PTE. LTD. (SG) 2023-02-16 US claimed
CN-113396145-A PFKFB3 inhibitors and uses thereof 盖罗发现有限责任公司 2021-09-14 CN claimed
WO-2020080979-A1 PFKFB3 INHIBITORS AND THEIR USES GERO DISCOVERY LIMITED LIABILITY COMPANY (RU) 2020-04-23 WO claimed
EP-2616450-A2 SULFONAMIDE COMPOUNDS Kancera AB (SE) 2013-07-24 EP 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
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
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 MAPT 845/4885LMNA 4383/4885TP53 2372/4885
US-20130172339-A1 SULFONAMIDE COMPOUNDS SULT1A1, STS, ARSA MAPT 3557/4885LMNA 1654/4885TP53 109/4885

“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.