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Zasocitinib

Zasocitinib

SCHEMBL30895694

[2H]CNc1cc(Nc2cccn(-c3ccccn3)c2=O)nc2c(C(=O)N[C@@H]3CC[C@H]3OC)cnn12

nearest known ligand 0.92

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Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 19/20 0.92
▸ JAK1 P23458 2/20 0.92
▸ JAK2 O60674 1/20 0.92
▸ CYP3A4 P08684 1/20 0.92
▸ CYP2C19 P33261 1/20 0.92

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
Zasocitinib SCHEMBL30895721 1.00 TYK2 (0.92) TYK2JAK1JAK2CYP3A4CYP2C19
Zasocitinib SCHEMBL20678885 0.96 TYK2 (1.00) TYK2JAK1JAK2CYP3A4CYP2C19
Zasocitinib SCHEMBL20678925 0.96 TYK2 (1.00) TYK2JAK1JAK2CYP3A4CYP2C19
Zasocitinib SCHEMBL20678921 0.96 TYK2 (1.00) TYK2JAK1JAK2CYP3A4CYP2C19
Zasocitinib SCHEMBL31710036 0.96 TYK2 (1.00) TYK2JAK1JAK2CYP3A4CYP2C19
Zasocitinib SCHEMBL20697064 0.96 TYK2 (1.00) TYK2JAK1JAK2CYP3A4CYP2C19
Zasocitinib SCHEMBL30596887 0.96 TYK2 (1.00) TYK2JAK1JAK2CYP3A4CYP2C19
SCHEMBL21227609 0.90 TYK2 (1.00) TYK2JAK1JAK2CYP3A4CYP2C19
SCHEMBL20687868 0.90 TYK2 (1.00) TYK2JAK1JAK2CYP3A4CYP2C19
SCHEMBL20687862 0.90 TYK2 (1.00) TYK2JAK1JAK2CYP3A4CYP2C19

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-118084920-A Five membered heteroaromatic pyrimidine-3-carboxamide derivatives, compositions and uses thereof 镇江圣安医药有限公司 2024-05-28 — — CN disclosed
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