SCHEMBL25077587

SCHEMBL25077587

CN1C(=O)[C@@H](NC=O)COc2ccc(C#CC(C)(C)O)cc21

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 20/20 0.60

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
SCHEMBL23075319 0.89 RIPK1 (0.63) RIPK1
SCHEMBL26381841 0.83 RIPK1 (0.56) RIPK1
SCHEMBL21531281 0.82 RIPK1 (0.63) RIPK1
SCHEMBL21531284 0.82 RIPK1 (0.63) RIPK1
SCHEMBL21531311 0.82 RIPK1 (0.55) RIPK1
SCHEMBL23085752 0.82 RIPK1 (0.59) RIPK1
SCHEMBL21531314 0.82 RIPK1 (0.55) RIPK1
SCHEMBL30635182 0.78 RIPK1 (0.82) RIPK1
SCHEMBL23075456 0.78 RIPK1 (0.61) RIPK1
SCHEMBL29842588 0.78 RIPK1 (0.81) 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-2023020486-A1 RIP1 KINASE INHIBITOR COMPOUND AND COMPOSITION AND USE THEREOF 广州市恒诺康医药科技有限公司 2023-02-23 — — WO disclosed
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