SCHEMBL30119819

SCHEMBL30119819

COc1c(N)ncnc1-c1cc(P(=O)(C2CC2)C2CC2)n(C)n1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 1/20 0.33
▸ JAK2 O60674 6/20 0.32
▸ JAK3 P52333 5/20 0.32
▸ PIK3CD O00329 5/20 0.32
▸ ABL1 P00519 5/20 0.32
▸ EGFR P00533 5/20 0.32
▸ HCK P08631 5/20 0.32
▸ SRC P12931 5/20 0.32
▸ KDR P35968 5/20 0.32
▸ PIK3CA P42336 5/20 0.32
▸ PIK3CB P42338 5/20 0.32
▸ MTOR P42345 5/20 0.32
▸ PIK3CG P48736 5/20 0.32
▸ EPHB4 P54760 5/20 0.32
▸ PRKDC P78527 5/20 0.32
▸ PI4KB Q9UBF8 4/20 0.32
▸ RPS6KB1 P23443 2/20 0.32
▸ AKT1 P31749 2/20 0.32
▸ AKT2 P31751 1/20 0.32
▸ AKT3 Q9Y243 1/20 0.32

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
SCHEMBL26983725 0.81 JMJD6 (0.30) RPS6KB1AKT1
SCHEMBL29156455 0.76 JMJD6 (0.33) RPS6KB1AKT1
SCHEMBL26983719 0.75 PIM1 (0.33) —
SCHEMBL30050566 0.75 PIM1 (0.33) —
SCHEMBL24783784 0.75 JAK2 (0.41) JAK2JAK1
SCHEMBL26983726 0.74 SYK (0.37) JAK2
SCHEMBL30780310 0.74 SYK (0.37) JAK2
SCHEMBL30780398 0.73 — —
SCHEMBL30780446 0.72 TYK2 (0.45) JAK2JAK3JAK1
SCHEMBL26983737 0.72 TYK2 (0.45) JAK2JAK3JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4551559-A1 HETEROARYL COMPOUNDS AS INHIBITORS OF TYK2/JAK1, COMPOSITION AND APPLICATION THEREOF Accro Bioscience (HK) Limited (HK) 2025-05-14 — — EP disclosed
EP-4351562-A1 HETEROARYL COMPOUNDS AS INHIBITORS OF TYK2, COMPOSITION AND APPLICATION THEREOF Accro Bioscience (HK) Limited (HK) 2024-04-17 — — EP disclosed
WO-2024010963-A1 HETEROARYL COMPOUNDS AS INHIBITORS OF TYK2/JAK1, COMPOSITION AND APPLICATION THEREOF ACCRO BIOSCIENCE (HK) LIMITED (CN) 2024-01-11 — — WO disclosed
WO-2022261524-A1 HETEROARYL COMPOUNDS AS INHIBITORS OF TYK2, COMPOSITION AND APPLICATION THEREOF ACCRO BIOSCIENCE (HK) LIMITED (CN) 2022-12-15 — — WO disclosed
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