SCHEMBL25300069

SCHEMBL25300069

Cc1cc(N[C@@H]2CCCN(CC#N)C2)nnc1Cl

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 13/20 0.51
IL1B P01584 11/20 0.46
KCNH2 Q12809 1/20 0.42
TNF P01375 2/20 0.41
CAMK2D Q13557 1/20 0.39

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
SCHEMBL25300070 1.00 NLRP3 (0.51) NLRP3IL1BKCNH2TNFCAMK2D
SCHEMBL30517832 0.86 NLRP3 (0.57) NLRP3IL1BKCNH2TNFCAMK2D
SCHEMBL25519368 0.86 NLRP3 (0.57) NLRP3IL1BKCNH2TNFCAMK2D
SCHEMBL25303253 0.83 NLRP3 (0.55) NLRP3IL1BKCNH2TNF
SCHEMBL25254731 0.83 NLRP3 (0.55) NLRP3IL1BKCNH2TNF
SCHEMBL29030489 0.81 IL1B (0.48) NLRP3IL1BKCNH2TNF
SCHEMBL25304051 0.81 IL1B (0.48) NLRP3IL1BKCNH2TNF
SCHEMBL22655051 0.80 IL1B (0.65) NLRP3IL1B
SCHEMBL22655048 0.80 IL1B (0.65) NLRP3IL1B
SCHEMBL31057218 0.80 IL1B (0.49) NLRP3IL1BKCNH2TNF

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.