SCHEMBL28358941

SCHEMBL28358941

NC(=O)c1nnc(-c2c(F)cccc2Cl)cc1Nc1ccc(N2CCN(C3CC3)CC2=O)cc1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 10/20 0.68
▸ JAK2 O60674 10/20 0.68
▸ JAK3 P52333 9/20 0.68
▸ JAK1 P23458 8/20 0.68
▸ SYK P43405 1/20 0.35
▸ WEE1 P30291 2/20 0.34
▸ P2RX7 Q99572 1/20 0.34
▸ MAPK8 P45983 1/20 0.34
▸ MAPK9 P45984 1/20 0.34
▸ MAPK10 P53779 1/20 0.34
▸ MCHR1 Q99705 1/20 0.34
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ GRM4 Q14833 1/20 0.33

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
SCHEMBL28362691 0.94 TYK2 (0.70) TYK2JAK2JAK3JAK1SYK
SCHEMBL28359048 0.91 TYK2 (0.55) TYK2JAK2JAK3JAK1WEE1
SCHEMBL29551775 0.91 TYK2 (0.55) TYK2JAK2JAK3JAK1WEE1
SCHEMBL28359206 0.88 JAK2 (0.68) TYK2JAK2JAK3JAK1SYK
SCHEMBL28362694 0.83 TYK2 (0.63) TYK2JAK2JAK3JAK1
Hydrochloric Acid SCHEMBL28362690 0.83 TYK2 (0.62) TYK2JAK2JAK3JAK1
SCHEMBL28362751 0.83 JAK2 (0.62) TYK2JAK2JAK3JAK1
SCHEMBL29922528 0.82 JAK3 (0.45) TYK2JAK2JAK3JAK1SYK
SCHEMBL29552531 0.82 JAK2 (0.43) TYK2JAK2JAK3JAK1WEE1
SCHEMBL28359087 0.81 TYK2 (1.00) TYK2JAK2JAK3JAK1MAPK8

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
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