SCHEMBL29552095

SCHEMBL29552095

CN1Cc2cc(Nc3cc(-c4c(F)cccc4F)nnc3C(=O)O)ccc2C1=O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 10/20 0.51
▸ TYK2 P29597 7/20 0.42
▸ JAK1 P23458 4/20 0.42
▸ JAK3 P52333 4/20 0.42
▸ MKNK1 Q9BUB5 1/20 0.39
▸ DHODH Q02127 1/20 0.39
▸ KIT P10721 1/20 0.37
▸ FLT3 P36888 1/20 0.37
▸ UGCG Q16739 2/20 0.37
▸ MYLK Q15746 1/20 0.36
▸ MAP3K5 Q99683 1/20 0.36
▸ PIK3CA P42336 1/20 0.36
▸ MTOR P42345 1/20 0.36

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
SCHEMBL28362689 0.92 JAK2 (0.51) JAK2TYK2JAK1JAK3MKNK1
SCHEMBL29922891 0.91 JAK2 (0.50) JAK2TYK2JAK1JAK3MKNK1
SCHEMBL29551757 0.91 JAK2 (0.50) JAK2TYK2JAK1JAK3MKNK1
SCHEMBL28358949 0.91 JAK2 (0.50) JAK2TYK2JAK1JAK3MKNK1
SCHEMBL29551936 0.81 MKNK1 (0.44) JAK2MKNK1KITFLT3PIK3CA
SCHEMBL28358955 0.76 JAK2 (0.57) JAK2TYK2JAK1JAK3DHODH
SCHEMBL29551959 0.74 JAK2 (0.46) JAK2TYK2JAK1JAK3DHODH
SCHEMBL29552149 0.73 TYK2 (0.46) JAK2TYK2JAK1JAK3DHODH
SCHEMBL29552473 0.73 JAK2 (0.44) JAK2TYK2JAK1JAK3DHODH
SCHEMBL29552441 0.72 JAK2 (0.48) JAK2TYK2JAK1JAK3DHODH

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
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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