SCHEMBL27028569

SCHEMBL27028569

COc1ccc(Cl)cc1-n1nc(NC(C)=O)c2cnc(-c3cnn4cccnc34)cc21

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 11/20 0.49
▸ JAK2 O60674 9/20 0.47
▸ JAK1 P23458 9/20 0.47
▸ TYK2 P29597 8/20 0.47
▸ JAK3 P52333 8/20 0.47

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
SCHEMBL29958575 1.00 IRAK4 (0.49) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL29958514 0.90 IRAK4 (0.46) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL27028646 0.90 IRAK4 (0.46) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL27028647 0.90 IRAK4 (0.45) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL29958975 0.90 IRAK4 (0.45) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL29958315 0.89 IRAK4 (0.49) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL27028640 0.89 IRAK4 (0.49) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL27028629 0.88 IRAK4 (0.44) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL29958733 0.86 IRAK4 (0.45) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL27028634 0.86 IRAK4 (0.45) IRAK4JAK2JAK1TYK2JAK3

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-4308122-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2024-01-24 — — EP claimed
CN-116981459-A Heterocyclic derivatives as janus kinase inhibitors 奇斯药制品公司 2023-10-31 — — CN claimed
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