SCHEMBL26522148

SCHEMBL26522148

Cc1cc(Nc2cc(Nc3ccc(C4CC4)cc3N(C)[S+](C)[O-])c(C(=O)NOCC(F)(F)F)cn2)nc(C)n1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 15/20 0.38
▸ JAK1 P23458 8/20 0.38
▸ JAK2 O60674 3/20 0.31
▸ JAK3 P52333 2/20 0.31
▸ MAP4K4 O95819 1/20 0.31
▸ GSK3B P49841 1/20 0.31
▸ IRAK4 Q9NWZ3 1/20 0.31
▸ MAP3K12 Q12852 1/20 0.30
▸ CNR2 P34972 2/20 0.30
▸ SYK P43405 1/20 0.30

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
SCHEMBL24498338 0.89 TYK2 (0.46) TYK2JAK1
SCHEMBL26522163 0.88 TYK2 (0.34) TYK2JAK1JAK2JAK3MAP4K4
SCHEMBL24498409 0.83 PIK3C3 (0.37) TYK2JAK1JAK2JAK3
SCHEMBL24498550 0.81 TYK2 (0.42) TYK2JAK1JAK2SYK
SCHEMBL24498193 0.80 TYK2 (0.48) TYK2JAK1
SCHEMBL29684805 0.80 TYK2 (0.48) TYK2JAK1
SCHEMBL26522201 0.80 TYK2 (0.40) TYK2JAK1JAK2JAK3SYK
SCHEMBL26532688 0.79 JAK1 (0.42) TYK2JAK1JAK2JAK3IRAK4
SCHEMBL26522858 0.79 TYK2 (0.42) TYK2JAK1
SCHEMBL24498431 0.78 DHODH (0.36) TYK2JAK1JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4257587-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shenzhen Chipscreen Biosciences Co., Ltd. (CN) 2023-10-11 — — EP disclosed
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