SCHEMBL28358944

SCHEMBL28358944

COC(=O)c1nnc(-c2c(F)cccc2Cl)cc1Nc1ccc(C(=O)OC(C)(C)C)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 5/20 0.51
▸ TYK2 P29597 5/20 0.51
▸ JAK1 P23458 3/20 0.51
▸ JAK3 P52333 2/20 0.51
▸ MAPT P10636 4/20 0.38
▸ TP53 P04637 2/20 0.38
▸ STAT3 P40763 2/20 0.37
▸ ABCG2 Q9UNQ0 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ CASP3 P42574 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ SENP7 Q9BQF6 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ NFKB2 Q00653 1/20 0.35
▸ RELA Q04206 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL29922577 1.00 JAK2 (0.51) JAK2TYK2JAK1JAK3MAPT
SCHEMBL29551766 0.93 JAK2 (0.51) JAK2TYK2JAK1JAK3MAPT
SCHEMBL29552028 0.92 JAK2 (0.62) JAK2TYK2JAK1JAK3MAPT
SCHEMBL28359255 0.92 JAK2 (0.62) JAK2TYK2JAK1JAK3MAPT
SCHEMBL29922940 0.88 JAK2 (0.49) JAK2TYK2JAK1JAK3MAPT
SCHEMBL28359019 0.88 JAK2 (0.49) JAK2TYK2JAK1JAK3MAPT
SCHEMBL28362644 0.85 JAK2 (0.52) JAK2TYK2JAK1JAK3STAT3
SCHEMBL28358863 0.85 ABCB1 (0.41) JAK2TYK2JAK1JAK3MAPT
SCHEMBL29922466 0.85 ABCB1 (0.41) JAK2TYK2JAK1JAK3MAPT
SCHEMBL29552483 0.85 JAK2 (0.52) JAK2TYK2JAK1JAK3STAT3

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 3 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
CN-110818641-A 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 2020-02-21 — — CN disclosed
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