SCHEMBL12459396

SCHEMBL12459396

COC(=O)c1cccc(CS(N)(=O)=O)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.67
CYP4F2 P78329 2/20 0.60
CYP4A11 Q02928 2/20 0.60
SLC7A5 Q01650 1/20 0.57
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA9 Q16790 1/20 0.54
POLB P06746 1/20 0.51
MRGPRX4 Q96LA9 2/20 0.50
MAPT P10636 2/20 0.50
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
PTPRB P23467 1/20 0.48
HIF1A Q16665 1/20 0.48
FOLH1 Q04609 1/20 0.47
HPGD P15428 1/20 0.47
LOX P28300 1/20 0.46

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
SCHEMBL3932525 0.87 LOXL2 (0.66) LOXL2CYP4F2CYP4A11SLC7A5CA12
SCHEMBL35360 0.86 LOXL2 (0.64) LOXL2CYP4F2CYP4A11SLC7A5CA12
SCHEMBL1272718 0.84 LOXL2 (0.62) LOXL2CYP4F2CYP4A11SLC7A5CA12
SCHEMBL5969642 0.84 LOXL2 (0.62) LOXL2CYP4F2CYP4A11SLC7A5CA12
SCHEMBL25630182 0.82 CA2 (0.50) LOXL2CA12CA1CA2CA9
SCHEMBL3929990 0.82 LOXL2 (0.59) LOXL2CYP4F2CYP4A11SLC7A5POLB
SCHEMBL5041329 0.80 CA1 (0.52) CA1CA2CA9POLBMAPT
SCHEMBL22193540 0.80 LOXL2 (0.62) LOXL2CYP4F2CYP4A11CA12CA1
SCHEMBL31720548 0.80 FOLH1 (0.58) CA1CA2CA9HIF1AFOLH1
SCHEMBL307892 0.80 LOXL2 (1.00) LOXL2CYP4F2CYP4A11SLC7A5MRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220227707-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2022-07-21 US disclosed
EP-3914583-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY Novartis AG (CH) 2021-12-01 EP disclosed
CN-113316566-A Compounds and compositions for treating conditions associated with NLRP activity 诺华股份有限公司 2021-08-27 CN disclosed
WO-2020154321-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS INFLAMMASOME RESEARCH, INC. (US) 2020-07-30 WO disclosed
WO-2020154321-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS INFLAMMASOME RESEARCH, INC. (US) 2020-07-30 WO disclosed
EP-2528895-B1 TRYPSIN-LIKE SERINE PROTEASE INHIBITORS, AND THEIR PREPARATION AND USE MEDICINES CO LEIPZIG GMBH (DE) 2016-03-30 EP disclosed
WO-2011094496-A2 TRYPSIN-LIKE SERINE PROTEASE INHIBITORS, AND THEIR PREPARATION AND USE THE MEDICINES COMPANY (US) 2011-08-04 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-20220227707-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 LOXL2 1003/4885CYP4F2 1028/4885CYP4A11 276/4885

“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.