SCHEMBL30181099

SCHEMBL30181099

COC(=O)c1ccncc1C(=O)OC(C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.57
KDM4E B2RXH2 4/20 0.57
GLA P06280 2/20 0.57
GAA P10253 2/20 0.57
LMNA P02545 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ATR Q13535 1/20 0.48
KMT2A Q03164 2/20 0.40
ATM Q13315 1/20 0.40
CYP46A1 Q9Y6A2 1/20 0.40
KDM4C Q9H3R0 2/20 0.39
MAPK8 P45983 1/20 0.39
MAPK9 P45984 1/20 0.39
MAPK10 P53779 1/20 0.39
HSD17B10 Q99714 3/20 0.39
RAB9A P51151 1/20 0.39
HTT P42858 2/20 0.38
HPGD P15428 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 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
SCHEMBL27348979 1.00 ALDH1A1 (0.57) ALDH1A1KDM4EGLAGAALMNA
SCHEMBL29416299 0.88 KDM4E (0.70) ALDH1A1KDM4EGLAGAALMNA
SCHEMBL68952 0.88 KDM4E (0.70) ALDH1A1KDM4EGLAGAALMNA
SCHEMBL31364268 0.85 KDM4C (0.47) ALDH1A1KDM4EGLAGAALMNA
SCHEMBL28257185 0.84 LMNA (0.47) ALDH1A1KDM4EGLAGAALMNA
SCHEMBL28257295 0.81 LMNA (0.44) ALDH1A1KDM4EGLAGAALMNA
SCHEMBL17462368 0.81 ALDH1A1 (0.45) ALDH1A1KDM4EGLAGAALMNA
SCHEMBL26132704 0.80 ALDH1A1 (0.44) ALDH1A1KDM4EGLAGAALMNA
SCHEMBL8123257 0.80 EGFR (0.41) ALDH1A1KDM4EGLAGAALMNA
SCHEMBL28101840 0.80 TDP1 (0.56) ALDH1A1KDM4EGLAGAALMNA

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
EP-4642763-A1 CRYSTALLINE FORMS OF NLRP3 INFLAMMASOME INHIBITORS, CHEMICAL PROCESSES AND CHEMICAL COMPOUNDS Astrazeneca AB (SE) 2025-11-05 EP claimed
WO-2024141534-A1 CRYSTALLINE FORMS OF NLRP3 INFLAMMASOME INHIBITORS, CHEMICAL PROCESSES AND CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2024-07-04 WO claimed
US-12503445-B2 Compounds and their use ASTRAZENECA AB (SE) 2025-12-23 US disclosed
EP-4642763-A1 CRYSTALLINE FORMS OF NLRP3 INFLAMMASOME INHIBITORS, CHEMICAL PROCESSES AND CHEMICAL COMPOUNDS Astrazeneca AB (SE) 2025-11-05 EP disclosed
EP-4642772-A1 NLRP3 INFLAMMASOME INHIBITORS Astrazeneca AB (SE) 2025-11-05 EP disclosed
EP-4628490-A2 NLRP3 INFLAMMASOME INHIBITORS Astrazeneca AB (SE) 2025-10-08 EP disclosed
EP-4363406-B1 NLRP3 INFLAMMASOME INHIBITORS ASTRAZENECA AB (SE) 2025-09-10 EP disclosed
WO-2024141534-A1 CRYSTALLINE FORMS OF NLRP3 INFLAMMASOME INHIBITORS, CHEMICAL PROCESSES AND CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2024-07-04 WO disclosed
WO-2024141535-A1 NLRP3 INFLAMMASOME INHIBITORS ASTRAZENECA AB (SE) 2024-07-04 WO disclosed
EP-4363406-A1 NLRP3 INFLAMMASOME INHIBITORS Astrazeneca AB (SE) 2024-05-08 EP disclosed
WO-2023275366-A1 NLRP3 INFLAMMASOME INHIBITORS ASTRAZENECA AB (SE) 2023-01-05 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-12503445-B2 Compounds and their use NLRP3, PYCARD, NLRP1 ALDH1A1 1607/4885KDM4E 2467/4885GLA 1405/4885

“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.