SCHEMBL29030489

SCHEMBL29030489

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

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IL1B P01584 10/20 0.48
NLRP3 Q96P20 14/20 0.46
KCNH2 Q12809 1/20 0.41
TNF P01375 1/20 0.41

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
SCHEMBL25304051 1.00 IL1B (0.48) IL1BNLRP3KCNH2TNF
SCHEMBL30517841 0.87 NLRP3 (0.45) IL1BNLRP3KCNH2TNF
SCHEMBL31057370 0.86 IL1B (0.44) IL1BNLRP3KCNH2TNF
SCHEMBL31057098 0.86 IL1B (0.43) IL1BNLRP3KCNH2TNF
SCHEMBL31057334 0.86 IL1B (0.43) IL1BNLRP3KCNH2TNF
SCHEMBL30517832 0.85 NLRP3 (0.57) IL1BNLRP3KCNH2TNF
SCHEMBL25519368 0.85 NLRP3 (0.57) IL1BNLRP3KCNH2TNF
SCHEMBL31057134 0.85 IL1B (0.43) IL1BNLRP3KCNH2TNF
SCHEMBL25303253 0.84 NLRP3 (0.55) IL1BNLRP3KCNH2TNF
SCHEMBL25254731 0.84 NLRP3 (0.55) IL1BNLRP3KCNH2TNF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4646197-A2 ORGANIC COMPOUNDS AS NLRP3 INHIBITORS Kodiak Sciences Inc. (US) 2025-11-12 EP disclosed
WO-2024148029-A2 ORGANIC COMPOUNDS AS NLRP3 INHIBITORS KODIAK SCIENCES INC. (US) 2024-07-11 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