SCHEMBL29922682

SCHEMBL29922682

NC(=O)c1nncc(-c2c(F)cccc2F)c1Nc1ccc(CC(=O)N2CCOCC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 10/20 0.51
▸ JAK2 O60674 4/20 0.47
▸ JAK1 P23458 4/20 0.47
▸ JAK3 P52333 4/20 0.47
▸ MAPT P10636 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ EGFR P00533 2/20 0.40
▸ PTK2 Q05397 1/20 0.39
▸ STAT6 P42226 1/20 0.38

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
SCHEMBL29922801 0.80 RAB9A (0.54) TYK2JAK2JAK1JAK3MAPT
SCHEMBL28362776 0.80 TYK2 (0.66) TYK2JAK2JAK1JAK3MAPT
SCHEMBL29923095 0.80 JAK2 (0.66) TYK2JAK2JAK1JAK3STAT6
SCHEMBL29922889 0.76 JAK2 (0.52) TYK2JAK2JAK1JAK3
SCHEMBL29922923 0.76 JAK2 (0.40) TYK2JAK2JAK1JAK3
SCHEMBL29922887 0.76 JAK1 (0.40) TYK2JAK2JAK1JAK3
SCHEMBL29922737 0.75 TYK2 (0.67) TYK2JAK2JAK1JAK3STAT6
SCHEMBL29922762 0.73 JAK2 (0.46) TYK2JAK2JAK1JAK3
SCHEMBL29922608 0.73 JAK2 (0.39) TYK2JAK2JAK1JAK3
SCHEMBL29922684 0.73 TYK2 (0.40) TYK2JAK2JAK1JAK3MAPT

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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