SCHEMBL27293243

SCHEMBL27293243

COc1c(Nc2nc(NC(C)c3cn(C)nc3C)ncc2C(=O)O)cccc1-c1nnc(C)o1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 6/20 0.43
▸ JAK1 P23458 2/20 0.43
▸ SYK P43405 11/20 0.40
▸ JAK3 P52333 1/20 0.37
▸ AXL P30530 1/20 0.35
▸ IDH1 O75874 1/20 0.35

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
SCHEMBL30923245 1.00 TYK2 (0.43) TYK2JAK1SYKJAK3AXL
SCHEMBL27291200 0.95 SYK (0.47) TYK2JAK1SYKJAK3
SCHEMBL30923162 0.95 SYK (0.47) TYK2JAK1SYKJAK3
SCHEMBL27293280 0.92 SYK (0.41) TYK2JAK1SYKJAK3AXL
SCHEMBL27417191 0.81 JAK3 (0.49) TYK2JAK1SYKJAK3AXL
SCHEMBL27291099 0.80 SYK (0.48) TYK2JAK1SYKJAK3
SCHEMBL27293318 0.80 TYK2 (0.44) TYK2JAK1SYKAXL
SCHEMBL27293373 0.79 JAK1 (0.44) TYK2JAK1SYKJAK3AXL
SCHEMBL27298258 0.77 TYK2 (0.44) TYK2JAK1SYKAXL
SCHEMBL27294015 0.77 TYK2 (0.59) TYK2JAK1JAK3AXL

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
WO-2024107658-A2 INHIBITORS OF TYK2 VYRNWY THERAPEUTICS, INC. (US) 2024-05-23 — — WO disclosed
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