SCHEMBL30833953

SCHEMBL30833953

OCCN1CCC[C@@H](Nc2cc(C3CC3)c(Cl)nn2)C1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 12/20 0.47
IL1B P01584 7/20 0.47
SMYD3 Q9H7B4 2/20 0.38
KAT2B Q92831 2/20 0.36
KCNH2 Q12809 1/20 0.36
TNF P01375 1/20 0.36

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
SCHEMBL31021469 0.86 NLRP3 (0.48) NLRP3IL1BKAT2BKCNH2TNF
SCHEMBL30833903 0.86 KAT2B (0.53) NLRP3IL1BKAT2BKCNH2
SCHEMBL25254731 0.85 NLRP3 (0.55) NLRP3IL1BKCNH2TNF
SCHEMBL25303253 0.85 NLRP3 (0.55) NLRP3IL1BKCNH2TNF
SCHEMBL30833975 0.82 IL1B (0.55) NLRP3IL1BKCNH2TNF
SCHEMBL30833884 0.82 IL1B (0.55) NLRP3IL1BKCNH2TNF
SCHEMBL25303027 0.82 IL1B (0.53) NLRP3IL1BKAT2B
SCHEMBL25255553 0.82 IL1B (0.53) NLRP3IL1BKAT2B
SCHEMBL30834003 0.79 IL1B (0.52) NLRP3IL1BKAT2B
SCHEMBL22655169 0.79 IL1B (0.55) NLRP3IL1BKAT2BKCNH2TNF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4613749-A1 NLRP3 INFLAMMASOME INHIBITOR AND USE THEREOF TransThera Sciences (Nanjing), Inc. (CN) 2025-09-10 EP disclosed
CN-117986258-A NLRP3 inflammation corpuscle inhibitor and application thereof 药捷安康(南京)科技股份有限公司 2024-05-07 CN disclosed