SCHEMBL29922888

SCHEMBL29922888

Cn1cc(Nc2c(-c3c(F)cccc3F)cnnc2C(N)=O)ccc1=O

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 1/20 0.37
▸ MKNK2 Q9HBH9 1/20 0.37
▸ JAK3 P52333 12/20 0.36
▸ JAK1 P23458 11/20 0.36
▸ TYK2 P29597 11/20 0.36
▸ JAK2 O60674 10/20 0.36
▸ BTK Q06187 1/20 0.35
▸ ADORA2A P29274 2/20 0.34
▸ LRRK2 Q5S007 1/20 0.34
▸ MAP2K2 P36507 2/20 0.33
▸ MAP2K1 Q02750 2/20 0.33
▸ MET P08581 1/20 0.33
▸ ALK Q9UM73 1/20 0.33
▸ PIM1 P11309 1/20 0.33
▸ PIM3 Q86V86 1/20 0.33
▸ PIM2 Q9P1W9 1/20 0.33

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
SCHEMBL29922756 0.79 JAK2 (0.40) JAK3JAK1TYK2JAK2BTK
SCHEMBL29922608 0.79 JAK2 (0.39) JAK3JAK1TYK2JAK2
SCHEMBL29922762 0.79 JAK2 (0.46) JAK3JAK1TYK2JAK2
SCHEMBL29922701 0.79 JAK2 (0.41) MKNK1JAK3JAK1TYK2JAK2
SCHEMBL29922684 0.78 TYK2 (0.40) JAK3JAK1TYK2JAK2LRRK2
SCHEMBL29922798 0.77 JAK3 (0.52) JAK3JAK1TYK2JAK2PIM1
SCHEMBL29922883 0.77 TYK2 (0.40) JAK3JAK1TYK2JAK2BTK
SCHEMBL29922706 0.77 JAK2 (0.43) JAK3JAK1TYK2JAK2LRRK2
SCHEMBL28362822 0.76 JAK2 (0.54) MKNK1MKNK2JAK3JAK1TYK2
SCHEMBL29922700 0.76 JAK2 (0.43) JAK3JAK1TYK2JAK2

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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