SCHEMBL29551995

SCHEMBL29551995

NC(=O)c1nnc(-c2c(F)cccc2Cl)cc1Nc1ccc(C(=O)O)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 11/20 0.69
▸ TYK2 P29597 10/20 0.69
▸ JAK1 P23458 9/20 0.69
▸ JAK3 P52333 9/20 0.69
▸ AURKA O14965 3/20 0.41
▸ AURKB Q96GD4 3/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ BMPR1B O00238 1/20 0.40
▸ PLK4 O00444 1/20 0.40
▸ PDPK1 O15530 1/20 0.40
▸ STK17B O94768 1/20 0.40
▸ STK10 O94804 1/20 0.40
▸ CHEK2 O96017 1/20 0.40
▸ ABL1 P00519 1/20 0.40
▸ EGFR P00533 1/20 0.40
▸ LCK P06239 1/20 0.40
▸ FYN P06241 1/20 0.40
▸ YES1 P07947 1/20 0.40
▸ LYN P07948 1/20 0.40

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
SCHEMBL28359167 1.00 JAK2 (0.69) JAK2TYK2JAK1JAK3AURKA
SCHEMBL29552249 0.92 TYK2 (0.58) JAK2TYK2JAK1JAK3AURKA
SCHEMBL28359236 0.92 TYK2 (0.58) JAK2TYK2JAK1JAK3AURKA
SCHEMBL29551876 0.87 TYK2 (0.66) JAK2TYK2JAK1JAK3AURKA
SCHEMBL28359071 0.87 TYK2 (0.66) JAK2TYK2JAK1JAK3AURKA
SCHEMBL29552028 0.86 JAK2 (0.62) JAK2TYK2JAK1JAK3SYK
SCHEMBL29552138 0.85 JAK2 (0.64) JAK2TYK2JAK1JAK3RAB9A
SCHEMBL28359283 0.85 JAK2 (0.64) JAK2TYK2JAK1JAK3RAB9A
SCHEMBL28359124 0.85 JAK2 (0.66) JAK2TYK2JAK1JAK3SYK
SCHEMBL29551888 0.83 JAK2 (0.59) JAK2TYK2JAK1JAK3SYK

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 2 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
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