SCHEMBL23057572

SCHEMBL23057572

Cc1cc(NC(=O)Oc2ccccc2)ccc1-c1cn(C)c2ncnc(N)c12

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 1/20 0.44
▸ EIF2AK3 Q9NZJ5 9/20 0.43
▸ EGFR P00533 1/20 0.43
▸ CDK1 P06493 1/20 0.43
▸ SRC P12931 1/20 0.43
▸ MET P08581 3/20 0.43
▸ AXL P30530 3/20 0.43
▸ RET P07949 2/20 0.40
▸ MAPKAPK2 P49137 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ METTL3 Q86U44 1/20 0.40
▸ CYP1A2 P05177 1/20 0.39

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
SCHEMBL29746667 1.00 FLT3 (0.44) FLT3EIF2AK3EGFRCDK1SRC
SCHEMBL23043903 0.87 FLT3 (0.50) FLT3EIF2AK3EGFRCDK1SRC
SCHEMBL29684025 0.86 FLT3 (0.55) FLT3EIF2AK3EGFRCDK1SRC
SCHEMBL23043916 0.86 FLT3 (0.55) FLT3EIF2AK3EGFRCDK1SRC
SCHEMBL29746670 0.85 MET (0.49) FLT3EIF2AK3EGFRCDK1SRC
SCHEMBL23043850 0.85 MET (0.49) FLT3EIF2AK3EGFRCDK1SRC
SCHEMBL29746539 0.83 EIF2AK3 (0.51) FLT3EIF2AK3EGFRCDK1SRC
SCHEMBL23044049 0.83 EIF2AK3 (0.51) FLT3EIF2AK3EGFRCDK1SRC
SCHEMBL23043868 0.83 EIF2S1 (0.55) FLT3EIF2AK3EGFRCDK1SRC
SCHEMBL30060949 0.83 EIF2S1 (0.55) FLT3EIF2AK3EGFRCDK1SRC

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-114710956-A PERK-INHIBITING PYRROLOPYRIMIDINE COMPOUNDS 希伯塞尔股份有限公司 2022-07-05 — — CN disclosed
WO-2021041975-A1 PERK INHIBITING PYRROLOPYRIMIDINE COMPOUNDS HIBERCELL, INC. (US) 2021-03-04 — — WO disclosed
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