SCHEMBL29922574

SCHEMBL29922574

CN1CCC(n2cc(Nc3c(-c4c(F)cccc4F)cnnc3C(N)=O)cn2)CC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 10/20 0.48
▸ JAK3 P52333 10/20 0.48
▸ JAK1 P23458 9/20 0.48
▸ EGFR P00533 1/20 0.43
▸ MELK Q14680 3/20 0.42
▸ FLT4 P35916 4/20 0.42
▸ KDR P35968 4/20 0.42
▸ CLK2 P49760 1/20 0.42
▸ LRRK2 Q5S007 1/20 0.42
▸ TYK2 P29597 3/20 0.42
▸ GSK3B P49841 1/20 0.41
▸ DYRK1A Q13627 1/20 0.41

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
SCHEMBL28362532 0.81 JAK2 (0.51) JAK2JAK3JAK1EGFRMELK
SCHEMBL29922902 0.80 JAK1 (0.41) JAK2JAK3JAK1TYK2
SCHEMBL29922756 0.77 JAK2 (0.40) JAK2JAK3JAK1EGFRLRRK2
SCHEMBL29922798 0.77 JAK3 (0.52) JAK2JAK3JAK1TYK2
SCHEMBL29922883 0.77 TYK2 (0.40) JAK2JAK3JAK1CLK2TYK2
SCHEMBL29922888 0.76 MKNK1 (0.37) JAK2JAK3JAK1LRRK2TYK2
SCHEMBL29552318 0.76 MAPK6 (0.43) JAK2JAK3JAK1MELK
SCHEMBL29552653 0.74 JAK2 (0.44) JAK2JAK3JAK1EGFRMELK
SCHEMBL29922701 0.73 JAK2 (0.41) JAK2JAK3JAK1LRRK2TYK2
SCHEMBL29922762 0.71 JAK2 (0.46) JAK2JAK3JAK1TYK2

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-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
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