SCHEMBL792880

SCHEMBL792880

Cc1cc(S(=O)(=O)Nc2cccc(-c3nnn[nH]3)c2)c(Cl)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PFKFB3 Q16875 5/20 0.54
MAPT P10636 3/20 0.53
LMNA P02545 2/20 0.53
TP53 P04637 1/20 0.53
THRB P10828 1/20 0.53
HSD17B1 P14061 1/20 0.49
HSD17B2 P37059 1/20 0.49
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
S1PR1 P21453 4/20 0.44
CDK1 P06493 1/20 0.42
CCNB1 P14635 1/20 0.42
CCNA2 P20248 1/20 0.42
CCND1 P24385 1/20 0.42
CDK2 P24941 1/20 0.42
CDK7 P50613 1/20 0.42
CCNH P51946 1/20 0.42
CCNA1 P78396 1/20 0.42
CDK6 Q00534 1/20 0.42
L3MBTL1 Q9Y468 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
SCHEMBL794311 0.91 PFKFB3 (0.65) PFKFB3MAPTLMNATP53THRB
SCHEMBL793550 0.88 MAPT (0.56) PFKFB3MAPTLMNATP53THRB
SCHEMBL793762 0.86 PFKFB3 (0.47) PFKFB3MAPTLMNATP53THRB
SCHEMBL794260 0.84 PFKFB3 (0.53) PFKFB3MAPTLMNAKMT2AMEN1
SCHEMBL793284 0.84 ALDH1A1 (0.52) PFKFB3MAPTKMT2AMEN1LNPEP
SCHEMBL793853 0.84 PFKFB3 (0.49) PFKFB3MAPTLMNATP53THRB
SCHEMBL793409 0.83 PFKFB3 (0.55) PFKFB3LMNATHRBKMT2AMEN1
SCHEMBL793856 0.83 PFKFB3 (0.67) PFKFB3MAPTLMNATP53LNPEP
SCHEMBL793555 0.82 PFKFB3 (0.66) PFKFB3MAPTLMNATP53THRB
SCHEMBL794362 0.82 PFKFB3 (0.68) PFKFB3MAPTLMNATP53THRB

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 952/4885MAPT 3557/4885LMNA 1654/4885

“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.