SCHEMBL23110874

SCHEMBL23110874

CC1(CO)Cc2cc(N)c(-c3ccncc3)cc2O1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 19/20 0.36
▸ FYN P06241 1/20 0.33

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
SCHEMBL23093788 0.84 IRAK4 (0.40) IRAK4
SCHEMBL23093908 0.80 RAB9A (0.38) IRAK4
SCHEMBL19030057 0.72 IRAK4 (0.45) IRAK4
SCHEMBL23110469 0.72 IRAK4 (0.75) IRAK4
SCHEMBL23110717 0.71 IRAK4 (0.48) IRAK4
SCHEMBL19046056 0.70 IRAK4 (0.44) IRAK4
SCHEMBL29502480 0.68 IRAK4 (0.54) IRAK4
SCHEMBL28654751 0.68 IRAK4 (0.43) IRAK4
SCHEMBL19029881 0.68 IRAK4 (0.54) IRAK4
SCHEMBL19030322 0.67 IRAK4 (0.50) IRAK4

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
CN-112480101-B IRAK4 kinase inhibitor, preparation and application thereof 中国科学院上海药物研究所 2022-11-25 — — CN disclosed
WO-2021047677-A1 IRAK4 KINASE INHIBITOR AND PREPARATION THEREOF AND USE THEREOF 中国科学院上海药物研究所 2021-03-18 — — WO disclosed
CN-112480101-A IRAK4 kinase inhibitor and preparation and application thereof 中国科学院上海药物研究所 2021-03-12 — — CN disclosed
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