Sugi Predict

Sugi Predict / Compounds / SCHEMBL30833850

SCHEMBL30833850

SCHEMBL30833850

C#Cc1ccc(-c2nnc(N[C@@H]3CCCC[C@H]3O)cc2C)c(OCOCC)c1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 7/20 0.39
▸ KCNH2 Q12809 1/20 0.35
▸ IL1B P01584 7/20 0.33
▸ HTR1A P08908 3/20 0.33
▸ TNF P01375 2/20 0.33
▸ CD274 Q9NZQ7 1/20 0.31
▸ CNR1 P21554 1/20 0.31

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
SCHEMBL30833899 0.90 NLRP3 (0.38) NLRP3KCNH2IL1BHTR1ATNF
SCHEMBL30833934 0.90 NLRP3 (0.38) NLRP3KCNH2IL1BHTR1ATNF
SCHEMBL30833952 0.85 NLRP3 (0.38) NLRP3KCNH2IL1BHTR1ATNF
SCHEMBL30833972 0.83 NLRP3 (0.48) NLRP3KCNH2IL1BTNF
SCHEMBL25301017 0.81 IL1B (0.52) NLRP3IL1BTNF
SCHEMBL25861524 0.81 IL1B (0.52) NLRP3IL1BTNF
SCHEMBL30834023 0.81 NLRP3 (0.43) NLRP3IL1B
SCHEMBL25859698 0.81 NLRP3 (0.32) NLRP3
SCHEMBL25257343 0.80 IL1B (0.54) NLRP3IL1B
SCHEMBL25296235 0.80 IL1B (0.54) 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 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