SCHEMBL29739986

SCHEMBL29739986

CCONC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1ccc(OC(C)C)cc1NS(C)(=O)=O

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 9/20 0.40
▸ TYK2 P29597 9/20 0.40
▸ JAK2 O60674 8/20 0.37
▸ KCNH2 Q12809 4/20 0.37
▸ KIT P10721 2/20 0.37
▸ ALDH1A1 P00352 3/20 0.36
▸ LMNA P02545 2/20 0.36
▸ USP2 O75604 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ RET P07949 1/20 0.35
▸ JAK3 P52333 3/20 0.35
▸ POLB P06746 2/20 0.34
▸ PKM P14618 1/20 0.34
▸ PDE4D Q08499 1/20 0.34
▸ MAPT P10636 2/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ TP53 P04637 2/20 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
SCHEMBL28839029 1.00 JAK1 (0.40) JAK1TYK2JAK2KCNH2KIT
SCHEMBL29739841 0.90 JAK1 (0.42) JAK1TYK2JAK2KCNH2KIT
SCHEMBL28839008 0.90 JAK1 (0.42) JAK1TYK2JAK2KCNH2KIT
SCHEMBL30490285 0.88 TYK2 (0.41) JAK1TYK2JAK2KCNH2KIT
SCHEMBL24497957 0.87 TYK2 (0.42) JAK1TYK2JAK2KCNH2KIT
SCHEMBL30846542 0.87 TYK2 (0.42) JAK1TYK2JAK2KCNH2KIT
SCHEMBL29739673 0.87 JAK1 (0.41) JAK1TYK2JAK2KCNH2KIT
SCHEMBL28838871 0.87 JAK1 (0.41) JAK1TYK2JAK2KCNH2KIT
SCHEMBL28839791 0.86 JAK1 (0.40) JAK1TYK2JAK2KCNH2KIT
SCHEMBL29739920 0.86 JAK1 (0.40) JAK1TYK2JAK2KCNH2KIT

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-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
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