SCHEMBL28362532

SCHEMBL28362532

CN1CCC(n2cc(Nc3cc(-c4c(F)cccc4F)nnc3C(N)=O)cn2)CC1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 12/20 0.51
▸ JAK3 P52333 12/20 0.51
▸ JAK1 P23458 11/20 0.51
▸ TYK2 P29597 5/20 0.51
▸ EGFR P00533 1/20 0.44
▸ MELK Q14680 3/20 0.42
▸ RORC P51449 1/20 0.41
▸ GSK3B P49841 2/20 0.41
▸ DYRK1A Q13627 2/20 0.41
▸ CLK2 P49760 1/20 0.41
▸ CLK3 P49761 1/20 0.41
▸ FLT4 P35916 1/20 0.41
▸ KDR P35968 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
SCHEMBL29552653 0.92 JAK2 (0.44) JAK2JAK3JAK1TYK2EGFR
SCHEMBL28359023 0.90 JAK2 (0.46) JAK2JAK3JAK1TYK2EGFR
SCHEMBL29552433 0.90 JAK2 (0.46) JAK2JAK3JAK1TYK2EGFR
SCHEMBL29922574 0.81 JAK2 (0.48) JAK2JAK3JAK1TYK2EGFR
SCHEMBL29552560 0.80 CHRNB2 (0.43) JAK2JAK3JAK1TYK2MELK
SCHEMBL28358968 0.80 ALK (0.42) JAK2JAK3JAK1TYK2MELK
SCHEMBL29922841 0.80 ALK (0.42) JAK2JAK3JAK1TYK2MELK
SCHEMBL28362626 0.80 JAK1 (0.49) JAK2JAK3JAK1TYK2RORC
SCHEMBL29552318 0.80 MAPK6 (0.43) JAK2JAK3JAK1MELKRORC
SCHEMBL28359197 0.80 DDB1 (0.46) JAK2JAK3JAK1TYK2EGFR

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 3 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
WO-2022032484-A1 PYRIDAZINE-3-FORMAMIDE COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 北京诺诚健华医药科技有限公司 2022-02-17 — — WO 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
Send feedback