SCHEMBL29552965

SCHEMBL29552965

NC(=O)c1nnc(-c2c(F)cccc2F)cc1Nc1ccc2c(c1)CN(C(=O)O)C2

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 14/20 0.54
▸ JAK2 O60674 12/20 0.54
▸ JAK1 P23458 6/20 0.54
▸ JAK3 P52333 6/20 0.54
▸ DHODH Q02127 1/20 0.36
▸ EGFR P00533 1/20 0.35
▸ BTK Q06187 1/20 0.35

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
SCHEMBL28358955 0.89 JAK2 (0.57) TYK2JAK2JAK1JAK3DHODH
SCHEMBL29551804 0.89 JAK2 (0.42) TYK2JAK2JAK1JAK3DHODH
SCHEMBL29922752 0.86 JAK2 (0.49) TYK2JAK2JAK1JAK3
SCHEMBL29552283 0.86 JAK2 (0.49) TYK2JAK2JAK1JAK3
SCHEMBL28359058 0.86 JAK2 (0.49) TYK2JAK2JAK1JAK3
SCHEMBL28359027 0.83 JAK2 (0.54) TYK2JAK2JAK1JAK3
SCHEMBL29551767 0.82 JAK2 (0.54) TYK2JAK2JAK1JAK3DHODH
SCHEMBL29551888 0.81 JAK2 (0.59) TYK2JAK2JAK1JAK3DHODH
SCHEMBL28359236 0.79 TYK2 (0.58) TYK2JAK2JAK1JAK3DHODH
SCHEMBL29552249 0.79 TYK2 (0.58) TYK2JAK2JAK1JAK3DHODH

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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