SCHEMBL21677274

SCHEMBL21677274

CC(C)(O)c1nn(CC(=O)O)c(=O)c2cc3sc(F)cc3n12

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 9/20 0.52
SLC18A2 Q05940 1/20 0.49
TP53 P04637 2/20 0.39
THRB P10828 2/20 0.37
MAPT P10636 1/20 0.37
KCNH2 Q12809 1/20 0.35

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
SCHEMBL21677403 0.87 NLRP3 (0.48) NLRP3SLC18A2TP53THRBMAPT
SCHEMBL21677208 0.86 NLRP3 (0.67) NLRP3SLC18A2TP53THRBMAPT
SCHEMBL21677400 0.81 NLRP3 (0.66) NLRP3KCNH2
SCHEMBL21677223 0.78 NLRP3 (0.65) NLRP3SLC18A2TP53THRBMAPT
SCHEMBL21677268 0.77 NLRP3 (0.46) NLRP3SLC18A2TP53THRBMAPT
SCHEMBL21677267 0.75 NLRP3 (0.61) NLRP3SLC18A2TP53KCNH2
SCHEMBL25360986 0.73 NLRP3 (0.48) NLRP3SLC18A2TP53THRBMAPT
SCHEMBL21632140 0.72 NLRP3 (0.82) NLRP3SLC18A2TP53THRBKCNH2
SCHEMBL21632287 0.72 NLRP3 (0.66) NLRP3SLC18A2THRBKCNH2
SCHEMBL21677312 0.72 NLRP3 (0.33) NLRP3SLC18A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12168012-B2 NLRP3 inflammasome inhibitors NOVARTIS AG (CH) 2024-12-17 US disclosed
EP-3827008-B1 NLRP3 INFLAMMASOME INHIBITORS NOVARTIS AG (CH) 2024-07-31 EP disclosed
CN-112424207-B NLRP3 inflammatory corpuscle inhibitor 诺华股份有限公司 2024-03-19 CN disclosed
US-20210308140-A1 NLRP3 INFLAMMASOME INHIBITORS NOVARTIS AG (CH) 2021-10-07 US disclosed
US-20210308140-A1 NLRP3 INFLAMMASOME INHIBITORS NOVARTIS AG (CH) 2021-10-07 US disclosed
WO-2020021447-A1 NLRP3 INFLAMMASOME INHIBITORS NOVARTIS AG (CH) 2020-01-30 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-12168012-B2 NLRP3 inflammasome inhibitors NLRP3, NLRP1, NOD1 NLRP3 1/4885SLC18A2 4539/4885TP53 1469/4885
US-20210308140-A1 NLRP3 INFLAMMASOME INHIBITORS NLRP3, NLRP1, NOD1 NLRP3 1/4885SLC18A2 4515/4885TP53 1466/4885

“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.