SCHEMBL28359299

SCHEMBL28359299

COC(=O)c1nnc(-c2c(F)cccc2F)cc1Nc1ccc(C(=O)OC(C)(C)C)nc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.44
▸ TYK2 P29597 5/20 0.40
▸ JAK2 O60674 7/20 0.39
▸ JAK1 P23458 3/20 0.39
▸ JAK3 P52333 3/20 0.39
▸ GABRA1 P14867 4/20 0.37
▸ GABRG2 P18507 4/20 0.37
▸ GABRB3 P28472 4/20 0.37
▸ GABRA5 P31644 4/20 0.37
▸ GABRA3 P34903 4/20 0.37
▸ GABRA2 P47869 4/20 0.37
▸ GABRA6 Q16445 4/20 0.37
▸ GABRA4 P48169 3/20 0.37
▸ RORC P51449 1/20 0.36
▸ MAPT P10636 1/20 0.34
▸ GABRP O00591 1/20 0.34
▸ GABRD O14764 1/20 0.34
▸ GABRB1 P18505 1/20 0.34
▸ GABRB2 P47870 1/20 0.34
▸ GABRE P78334 1/20 0.34

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
SCHEMBL29922511 1.00 DHODH (0.44) DHODHTYK2JAK2JAK1JAK3
SCHEMBL29552219 0.92 DHODH (0.48) DHODHTYK2JAK2JAK1JAK3
SCHEMBL29552324 0.91 JAK2 (0.48) DHODHTYK2JAK2JAK1JAK3
SCHEMBL28359105 0.91 JAK2 (0.48) DHODHTYK2JAK2JAK1JAK3
SCHEMBL29552248 0.84 ABCB1 (0.41) TYK2JAK2JAK1JAK3MAPT
SCHEMBL28358863 0.84 ABCB1 (0.41) TYK2JAK2JAK1JAK3MAPT
SCHEMBL29922466 0.84 ABCB1 (0.41) TYK2JAK2JAK1JAK3MAPT
SCHEMBL29922686 0.83 JAK2 (0.42) DHODHTYK2JAK2JAK1JAK3
SCHEMBL29922784 0.82 DHODH (0.45) DHODHTYK2JAK2JAK1JAK3
SCHEMBL28362738 0.82 DHODH (0.45) DHODHTYK2JAK2JAK1JAK3

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