SCHEMBL30490253

SCHEMBL30490253

CCONC(=O)c1cnccc1Nc1cccc(-c2cnn(C)c2)c1OC

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 10/20 0.47
▸ JAK2 O60674 3/20 0.39
▸ LRRK2 Q5S007 2/20 0.38
▸ SLC22A12 Q96S37 1/20 0.38
▸ JAK1 P23458 4/20 0.37
▸ CCNC P24863 1/20 0.37
▸ CDK8 P49336 1/20 0.37
▸ USP30 Q70CQ3 1/20 0.37
▸ IRAK4 Q9NWZ3 1/20 0.36
▸ IKBKE Q14164 1/20 0.36
▸ TBK1 Q9UHD2 1/20 0.36

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
SCHEMBL30490300 0.89 TYK2 (0.48) TYK2JAK2LRRK2JAK1CCNC
SCHEMBL29686783 0.85 TYK2 (0.47) TYK2JAK2JAK1IRAK4
SCHEMBL24498517 0.85 TYK2 (0.47) TYK2JAK2JAK1IRAK4
SCHEMBL30490252 0.83 JAK2 (0.55) TYK2JAK2JAK1
SCHEMBL30724634 0.83 TYK2 (0.49) TYK2JAK2JAK1
SCHEMBL29685327 0.81 JAK2 (0.62) TYK2JAK2JAK1
SCHEMBL24498190 0.81 JAK2 (0.62) TYK2JAK2JAK1
SCHEMBL30490071 0.81 TYK2 (0.51) TYK2JAK2JAK1
SCHEMBL30490068 0.80 TYK2 (0.46) TYK2JAK2JAK1
SCHEMBL30490080 0.80 TYK2 (0.49) TYK2JAK1

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
CN-116283954-A Hydroxamate compound, preparation method and application thereof 深圳微芯生物科技股份有限公司 2023-06-23 — — CN disclosed
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