SCHEMBL29684729

SCHEMBL29684729

CONC(=O)c1cnc(Nc2cccc(F)n2)cc1Nc1cccc(-c2cnn(C)c2)c1N(C)S(C)(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 16/20 0.41
▸ JAK1 P23458 13/20 0.41
▸ TTK P33981 3/20 0.41
▸ KCNH2 Q12809 1/20 0.40
▸ JAK2 O60674 3/20 0.39
▸ JAK3 P52333 2/20 0.39

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
SCHEMBL24497998 1.00 TYK2 (0.41) TYK2JAK1TTKKCNH2JAK2
SCHEMBL24498256 0.86 JAK1 (0.44) TYK2JAK1KCNH2JAK2JAK3
SCHEMBL29684955 0.86 JAK1 (0.44) TYK2JAK1KCNH2JAK2JAK3
SCHEMBL24497580 0.86 TYK2 (0.51) TYK2JAK1JAK2
SCHEMBL24497997 0.85 TTK (0.39) TYK2JAK1TTK
SCHEMBL29686026 0.85 TTK (0.39) TYK2JAK1TTK
SCHEMBL24498184 0.85 JAK1 (0.51) TYK2JAK1KCNH2JAK2JAK3
SCHEMBL24497575 0.84 JAK1 (0.41) TYK2JAK1KCNH2JAK2JAK3
SCHEMBL24497576 0.83 JAK1 (0.42) TYK2JAK1KCNH2JAK2JAK3
SCHEMBL29685149 0.83 JAK1 (0.42) TYK2JAK1KCNH2JAK2JAK3

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114901656-A Hydroximic acid ester compound, preparation method and application thereof 深圳微芯生物科技股份有限公司 2022-08-12 — — CN claimed
WO-2022117016-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 深圳微芯生物科技股份有限公司 2022-06-09 — — WO claimed
EP-4257587-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shenzhen Chipscreen Biosciences Co., Ltd. (CN) 2023-10-11 — — EP disclosed
CN-114901656-B Hydroximic acid ester compound, preparation method and application thereof 深圳微芯生物科技股份有限公司 2023-04-07 — — CN disclosed
CN-114901656-A Hydroximic acid ester compound, preparation method and application thereof 深圳微芯生物科技股份有限公司 2022-08-12 — — CN disclosed
WO-2022117016-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 深圳微芯生物科技股份有限公司 2022-06-09 — — WO disclosed
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