SCHEMBL29926951

SCHEMBL29926951

NS(=O)(=O)c1cc2ccccc2o1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 13/20 1.00
CA1 P00915 2/20 0.61
CA9 Q16790 2/20 0.61
CA12 O43570 1/20 0.61
AKR1B1 P15121 2/20 0.50
FLT3 P36888 1/20 0.50
TYR P14679 1/20 0.48
DAO P14920 1/20 0.48
HPGD P15428 1/20 0.48
POLB P06746 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
LOXL2 Q9Y4K0 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
SCHEMBL1156380 1.00 CA2 (1.00) CA2CA1CA9CA12AKR1B1
Pyridine SCHEMBL15227441 0.88 CA2 (0.78) CA2CA1CA9CA12AKR1B1
SCHEMBL7137894 0.83 CA2 (0.71) CA2CA1CA9CA12AKR1B1
SCHEMBL329665 0.82 CA2 (0.69) CA2CA1CA9CA12AKR1B1
SCHEMBL720789 0.80 CA2 (0.67) CA2CA1CA9CA12AKR1B1
SCHEMBL31695410 0.80 CA2 (0.67) CA2CA1CA9CA12AKR1B1
SCHEMBL9063028 0.80 CA2 (0.67) CA2CA1CA9CA12AKR1B1
SCHEMBL16985241 0.80 CA2 (0.67) CA2CA1CA9CA12AKR1B1
SCHEMBL1655317 0.80 CA2 (0.67) CA2CA1CA9CA12AKR1B1
SCHEMBL4023070 0.78 CA2 (0.65) CA2CA1CA9CA12AKR1B1

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
CN-116622075-A Nano fluorescent temperature indicator and preparation method and application thereof 江苏大学 2023-08-22 CN claimed
CN-116622075-A Nano fluorescent temperature indicator and preparation method and application thereof 江苏大学 2023-08-22 CN disclosed
US-11718631-B2 Sulphonamides and compositions thereof for treating conditions associated with NLRP activity NOVARTIS AG (CH) 2023-08-08 US disclosed
EP-3445749-B1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2022-12-21 EP disclosed
US-20220387397-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2022-12-08 US disclosed
US-20220340591-A1 SULPHONAMIDES AND COMPOSITIONS THEREOF FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2022-10-27 US disclosed
US-11447460-B2 Compounds and compositions for treating conditions associated with NLRP activity NOVARTIS AG (CH) 2022-09-20 US 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 (4 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-20220387397-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 CA2 1337/4885CA1 3842/4885CA9 3237/4885
US-20220340591-A1 SULPHONAMIDES AND COMPOSITIONS THEREOF FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 CA2 698/4885CA1 2501/4885CA9 1594/4885
US-11718631-B2 Sulphonamides and compositions thereof for treating conditions associated with NLRP activity NLRP1, NLRP3, NOD1 CA2 698/4885CA1 2501/4885CA9 1594/4885
US-11447460-B2 Compounds and compositions for treating conditions associated with NLRP activity NLRP1, NLRP3, NOD1 CA2 1336/4885CA1 3847/4885CA9 3178/4885

“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.