SCHEMBL25256129

SCHEMBL25256129

C#Cc1ccc(-c2nnc(N[C@@H]3CCCN(CC#N)C3)cc2C)c(OCOCC)c1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 12/20 0.57
IL1B P01584 8/20 0.41
KCNH2 Q12809 1/20 0.35
JAK1 P23458 1/20 0.34
JAK3 P52333 1/20 0.34
TNF P01375 1/20 0.33

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
SCHEMBL25304328 1.00 NLRP3 (0.57) NLRP3IL1BKCNH2JAK1JAK3
SCHEMBL30834007 0.92 NLRP3 (0.62) NLRP3IL1BKCNH2
SCHEMBL25302189 0.89 NLRP3 (0.55) NLRP3IL1BKCNH2
SCHEMBL25263725 0.89 NLRP3 (0.55) NLRP3IL1BKCNH2
SCHEMBL25257343 0.88 IL1B (0.54) NLRP3IL1B
SCHEMBL25296235 0.88 IL1B (0.54) NLRP3IL1B
SCHEMBL25294782 0.88 NLRP3 (0.56) NLRP3IL1BKCNH2JAK1JAK3
SCHEMBL25294783 0.88 NLRP3 (0.56) NLRP3IL1BKCNH2JAK1JAK3
SCHEMBL29030498 0.88 NLRP3 (0.53) NLRP3IL1BKCNH2
SCHEMBL29030493 0.88 NLRP3 (0.53) NLRP3IL1BKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250152584-A1 NLRP3 INFLAMMASOME INHIBITOR AND USES THEREOF TRANSTHERA SCIENCES (NANJING), INC. (CN) 2025-05-15 US disclosed
CN-119798221-A NLRP3 inflammation corpuscle inhibitor and application thereof 药捷安康(南京)科技股份有限公司 2025-04-11 CN disclosed
EP-4461729-A1 ANTIGEN BINDING PROTEIN TARGETING MSLN AND USE THEREOF Transthera Sciences (Nanjing), Inc. (CN) 2024-11-13 EP disclosed
WO-2023131277-A1 NLRP3 INFLAMMASOME INHIBITOR AND USES THEREOF 药捷安康(南京)科技股份有限公司 2023-07-13 WO disclosed
CN-116410140-A NLRP3 inflammation corpuscle inhibitor and application thereof 药捷安康(南京)科技股份有限公司 2023-07-11 CN 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-20250152584-A1 NLRP3 INFLAMMASOME INHIBITOR AND USES THEREOF NLRP3, NLRP1, PYCARD NLRP3 1/4885IL1B 7/4885KCNH2 3859/4885

“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.