SCHEMBL28359283

SCHEMBL28359283

CC(C)(C(=O)O)c1ccc(Nc2cc(-c3c(F)cccc3Cl)nnc2C(N)=O)cc1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 15/20 0.64
▸ TYK2 P29597 8/20 0.64
▸ JAK1 P23458 7/20 0.64
▸ JAK3 P52333 7/20 0.64
▸ TRPV1 Q8NER1 1/20 0.39
▸ SYK P43405 1/20 0.38
▸ PDE4B Q07343 1/20 0.37
▸ PDE4D Q08499 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ AKR1C3 P42330 1/20 0.36
▸ AKR1C2 P52895 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
SCHEMBL29552138 1.00 JAK2 (0.64) JAK2TYK2JAK1JAK3TRPV1
SCHEMBL29552215 0.93 JAK2 (0.54) JAK2TYK2JAK1JAK3SYK
SCHEMBL28359103 0.93 JAK2 (0.54) JAK2TYK2JAK1JAK3SYK
SCHEMBL28359046 0.91 JAK2 (0.60) JAK2TYK2JAK1JAK3SYK
SCHEMBL29552451 0.91 JAK2 (0.60) JAK2TYK2JAK1JAK3SYK
SCHEMBL28359167 0.85 JAK2 (0.69) JAK2TYK2JAK1JAK3SYK
SCHEMBL29551995 0.85 JAK2 (0.69) JAK2TYK2JAK1JAK3SYK
SCHEMBL28359255 0.85 JAK2 (0.62) JAK2TYK2JAK1JAK3SYK
SCHEMBL29552028 0.85 JAK2 (0.62) JAK2TYK2JAK1JAK3SYK
SCHEMBL29552328 0.84 JAK2 (0.51) JAK2TYK2JAK1JAK3SYK

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
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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