SCHEMBL26493523

SCHEMBL26493523

C(=C1C2CCCC1C2)c1ccc2ncncc2c1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 9/20 0.42
▸ PIK3CD O00329 1/20 0.37
▸ PIK3CA P42336 1/20 0.37
▸ FGFR4 P22455 1/20 0.33
▸ TDO2 P48775 1/20 0.32
▸ MGLL Q99685 2/20 0.31
▸ PSMB5 P28074 1/20 0.31
▸ AR P10275 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
SCHEMBL26493498 0.78 CCNE1 (0.40) —
SCHEMBL26457407 0.76 NPC1 (0.44) PIK3CDPIK3CA
SCHEMBL4156184 0.73 EGFR (0.55) EGFRPIK3CDPIK3CAFGFR4TDO2
SCHEMBL2011008 0.73 EGFR (0.55) EGFRPIK3CDPIK3CAFGFR4TDO2
SCHEMBL27741827 0.70 EGFR (0.55) EGFRPIK3CDPIK3CAFGFR4TDO2
SCHEMBL27558297 0.66 EGFR (0.50) EGFRTDO2PSMB5
SCHEMBL26094619 0.66 MEN1 (0.58) PIK3CDPIK3CA
SCHEMBL4441520 0.65 ADAMTS5 (0.46) EGFRPIK3CDPIK3CA
SCHEMBL3862951 0.64 PIM1 (0.69) PIK3CDPIK3CA
SCHEMBL6418533 0.64 MEN1 (0.51) PIK3CDPIK3CA

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-2023072969-A1 IMIDAZOLONE DERIVATIVES AS INHIBITORS OF PROTEIN KINASES IN PARTICULAR DYRK1A, CLK1 AND/OR CLK4 PERHA PHARMACEUTICALS (FR) 2023-05-04 — — WO disclosed
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