SCHEMBL28359236

SCHEMBL28359236

NC(=O)c1nnc(-c2c(F)cccc2F)cc1Nc1ccc(C(=O)O)cc1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 14/20 0.58
▸ JAK2 O60674 12/20 0.58
▸ JAK1 P23458 10/20 0.58
▸ JAK3 P52333 10/20 0.58
▸ DHODH Q02127 1/20 0.43
▸ TTR P02766 1/20 0.43
▸ AURKA O14965 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ GFER P55789 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ HSD17B10 Q99714 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
SCHEMBL29552249 1.00 TYK2 (0.58) TYK2JAK2JAK1JAK3DHODH
SCHEMBL28359167 0.92 JAK2 (0.69) TYK2JAK2JAK1JAK3DHODH
SCHEMBL29551995 0.92 JAK2 (0.69) TYK2JAK2JAK1JAK3DHODH
SCHEMBL29551888 0.90 JAK2 (0.59) TYK2JAK2JAK1JAK3DHODH
SCHEMBL29551925 0.90 JAK1 (0.52) TYK2JAK2JAK1JAK3AURKA
SCHEMBL28362555 0.90 JAK1 (0.52) TYK2JAK2JAK1JAK3AURKA
SCHEMBL28362706 0.88 JAK2 (0.55) TYK2JAK2JAK1JAK3
SCHEMBL29551923 0.85 TYK2 (0.55) TYK2JAK2JAK1JAK3DHODH
SCHEMBL28884120 0.85 TYK2 (0.55) TYK2JAK2JAK1JAK3DHODH
SCHEMBL28363100 0.85 JAK2 (0.57) 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 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
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