SCHEMBL29922700

SCHEMBL29922700

CS(=O)(=O)NC(=O)c1ccc(Nc2c(-c3c(F)cccc3F)cnnc2C(N)=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 17/20 0.43
▸ JAK1 P23458 17/20 0.43
▸ TYK2 P29597 17/20 0.43
▸ JAK3 P52333 17/20 0.43
▸ SCN9A Q15858 2/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37

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
SCHEMBL29922762 0.88 JAK2 (0.46) JAK2JAK1TYK2JAK3
SCHEMBL29922681 0.87 JAK2 (0.40) JAK2JAK1TYK2JAK3
SCHEMBL29922608 0.82 JAK2 (0.39) JAK2JAK1TYK2JAK3
SCHEMBL29922706 0.81 JAK2 (0.43) JAK2JAK1TYK2JAK3
SCHEMBL29922596 0.80 JAK2 (0.61) JAK2JAK1TYK2JAK3
SCHEMBL29922684 0.79 TYK2 (0.40) JAK2JAK1TYK2JAK3
SCHEMBL29922889 0.79 JAK2 (0.52) JAK2JAK1TYK2JAK3
SCHEMBL29922637 0.79 TYK2 (0.63) JAK2JAK1TYK2JAK3HDAC6
SCHEMBL28362529 0.77 JAK2 (0.52) JAK2JAK1TYK2JAK3
SCHEMBL29922888 0.76 MKNK1 (0.37) JAK2JAK1TYK2JAK3

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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