SCHEMBL29552180

SCHEMBL29552180

CC(C)(C(=O)O)c1ccc(Nc2cc(-c3c(F)cccc3F)nnc2C(N)=O)nc1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 7/20 0.60
▸ JAK2 O60674 5/20 0.60
▸ JAK1 P23458 4/20 0.60
▸ JAK3 P52333 4/20 0.60
▸ SYK P43405 11/20 0.39
▸ KCNH2 Q12809 1/20 0.37
▸ DHODH Q02127 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
SCHEMBL28359026 1.00 TYK2 (0.60) TYK2JAK2JAK1JAK3SYK
SCHEMBL29551901 0.87 TYK2 (0.55) TYK2JAK2JAK1JAK3SYK
SCHEMBL28359051 0.87 TYK2 (0.55) TYK2JAK2JAK1JAK3SYK
SCHEMBL29552529 0.87 TYK2 (0.55) TYK2JAK2JAK1JAK3SYK
SCHEMBL28362925 0.87 TYK2 (0.61) TYK2JAK2JAK1JAK3SYK
SCHEMBL29552829 0.87 TYK2 (0.61) TYK2JAK2JAK1JAK3SYK
SCHEMBL28359103 0.86 JAK2 (0.54) TYK2JAK2JAK1JAK3SYK
SCHEMBL29552215 0.86 JAK2 (0.54) TYK2JAK2JAK1JAK3SYK
SCHEMBL29552360 0.83 TYK2 (0.65) TYK2JAK2JAK1JAK3SYK
SCHEMBL29552906 0.83 TYK2 (0.67) TYK2JAK2JAK1JAK3SYK

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
CN-110818641-B Pyridazine-3-formamide compound, preparation method and application thereof in medicine and pharmacology 北京诺诚健华医药科技有限公司 2022-10-14 — — CN disclosed
WO-2022032484-A1 PYRIDAZINE-3-FORMAMIDE COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 北京诺诚健华医药科技有限公司 2022-02-17 — — WO disclosed
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