SCHEMBL25879417

SCHEMBL25879417

Cc1cc(=O)c(C(=O)N[C@H]2COc3ccc(C#CC(C)(C)O)cc3N(C)C2=O)nn1-c1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 20/20 0.70

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
SCHEMBL25879364 0.89 RIPK1 (0.72) RIPK1
SCHEMBL25879300 0.89 RIPK1 (0.71) RIPK1
SCHEMBL25879302 0.87 RIPK1 (0.68) RIPK1
SCHEMBL25879303 0.87 RIPK1 (0.68) RIPK1
SCHEMBL25878968 0.87 RIPK1 (0.68) RIPK1
SCHEMBL23408408 0.85 RIPK1 (0.79) RIPK1
SCHEMBL25880437 0.84 RIPK1 (0.63) RIPK1
SCHEMBL25879418 0.83 RIPK1 (0.63) RIPK1
SCHEMBL23392055 0.82 RIPK1 (1.00) RIPK1
SCHEMBL30568276 0.82 RIPK1 (1.00) RIPK1

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
WO-2023138317-A1 COMPOUND HAVING RIPK1 INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR AND USE THEREOF 中国科学院上海药物研究所 2023-07-27 — — WO disclosed
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