SCHEMBL29164347

SCHEMBL29164347

CCOC(C)n1ccc(Br)n1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 1/20 0.31
▸ JAK1 P23458 1/20 0.31
▸ TYK2 P29597 1/20 0.31
▸ JAK3 P52333 1/20 0.31
▸ CD274 Q9NZQ7 1/20 0.30

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
SCHEMBL18528976 0.79 JAK2 (0.31) JAK2JAK1TYK2JAK3CD274
SCHEMBL569695 0.74 — —
SCHEMBL27091416 0.73 NPC1 (0.40) JAK2JAK1TYK2JAK3CD274
SCHEMBL31328918 0.70 PKM (0.41) —
SCHEMBL38651418 0.69 LPL (0.32) JAK2JAK1TYK2JAK3
SCHEMBL1300155 0.68 JAK2 (0.41) JAK2JAK1TYK2JAK3CD274
SCHEMBL18529005 0.67 AAK1 (0.38) —
SCHEMBL31473623 0.67 MAP4K1 (0.32) —
SCHEMBL22579526 0.66 — —
SCHEMBL23229674 0.66 PGR (0.31) —

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-117304111-A Synthesis method of darostaamine intermediate 江苏海悦康医药科技有限公司 2023-12-29 — — CN disclosed
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