SCHEMBL29030484

SCHEMBL29030484

C#Cc1ccc(-c2nnc(N[C@@H]3CCCN(C)C3)c(C3CCCCC3)c2C2CCCCC2)c(O)c1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 12/20 0.58
IL1B P01584 10/20 0.52

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
SCHEMBL30488547 1.00 NLRP3 (0.58) NLRP3IL1B
SCHEMBL29030490 1.00 NLRP3 (0.58) NLRP3IL1B
SCHEMBL30488523 1.00 NLRP3 (0.58) NLRP3IL1B
SCHEMBL25296201 0.96 NLRP3 (0.60) NLRP3IL1B
SCHEMBL25257249 0.96 NLRP3 (0.60) NLRP3IL1B
SCHEMBL31091185 0.87 NLRP3 (0.60) NLRP3IL1B
SCHEMBL25256054 0.83 NLRP3 (0.62) NLRP3IL1B
SCHEMBL25297240 0.83 NLRP3 (0.62) NLRP3IL1B
SCHEMBL29030504 0.83 NLRP3 (0.57) NLRP3IL1B
SCHEMBL30488478 0.83 NLRP3 (0.57) NLRP3IL1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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