SCHEMBL12786015

SCHEMBL12786015

COc1c(Cl)ccc(-c2nc(C=O)c3c(C)cn(C)c3n2)c1F

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ EIF2AK3 Q9NZJ5 2/20 0.32
▸ MEP1B Q16820 1/20 0.30
▸ MAPK14 Q16539 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
SCHEMBL11913442 0.85 EIF2AK3 (0.32) EIF2AK3MAPK14
SCHEMBL11918058 0.83 HSP90AA1 (0.30) —
SCHEMBL12786372 0.83 P2RX7 (0.37) —
SCHEMBL11918096 0.83 HSP90AA1 (0.41) —
SCHEMBL11902642 0.81 ALDH1A1 (0.34) EIF2AK3MEP1BMAPK14
SCHEMBL11918013 0.77 MEP1B (0.33) MEP1B
SCHEMBL13256089 0.76 DHPS (0.36) MEP1B
SCHEMBL11918082 0.75 MEP1B (0.33) MEP1B
SCHEMBL21584443 0.73 MEP1B (0.36) MEP1B
SCHEMBL11918158 0.72 EIF2AK3 (0.32) EIF2AK3

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-2011045561-A2 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2011-04-21 — — WO disclosed
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