SCHEMBL794002

SCHEMBL794002

CC1(C)CCc2cc(S(=O)(=O)Nc3cccc(-c4nnn[nH]4)c3)ccc2O1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 9/20 0.58
TRIM24 O15164 2/20 0.53
BRD1 O95696 1/20 0.53
BRPF1 P55201 1/20 0.53
GHSR Q92847 2/20 0.51
CYP2D6 P10635 2/20 0.51
MLNR O43193 1/20 0.51
PKLR P30613 2/20 0.42
DAGLA Q9Y4D2 2/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
KCNH2 Q12809 1/20 0.42
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PFKFB3 Q16875 2/20 0.38
LNPEP Q9UIQ6 1/20 0.38
BRD4 O60885 1/20 0.38

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
SCHEMBL21857637 0.84 PFKFB3 (0.58) PKMTRIM24BRD1BRPF1GHSR
SCHEMBL8557904 0.79 PKM (0.73) PKMTRIM24BRD1BRPF1GHSR
SCHEMBL794304 0.75 PFKFB3 (0.63) LMNAPFKFB3LNPEP
SCHEMBL27943370 0.74 MMP2 (0.59) PKMLMNAPFKFB3
SCHEMBL793299 0.74 PFKFB3 (0.65) PKMGHSRPKLRLMNASMN1; SMN2
SCHEMBL793607 0.74 PFKFB4 (0.64) LMNAPFKFB3LNPEP
SCHEMBL2740102 0.74 PKM (0.52) PKMTRIM24BRD1BRPF1GHSR
SCHEMBL794341 0.72 PFKFB4 (0.54) PFKFB3
SCHEMBL793433 0.72 PFKFB4 (0.67) PKMLMNASMN1; SMN2PFKFB3BRD4
SCHEMBL10239988 0.71 PKM (0.67) PKMTRIM24BRD1BRPF1GHSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 (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 PKM 29/4885TRIM24 2979/4885BRD1 2565/4885
US-20130172339-A1 SULFONAMIDE COMPOUNDS SULT1A1, STS, ARSA PKM 1612/4885TRIM24 4516/4885BRD1 1615/4885

“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.