SCHEMBL31337239

SCHEMBL31337239

COC(=O)Nc1ccc(-n2cnc3c(C)cc(-c4ncnn4-c4ccc(F)c(OC)c4)cc32)cn1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 6/20 0.33
▸ CACNA1H O95180 3/20 0.32
▸ TP53 P04637 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ TTK P33981 3/20 0.32
▸ PTGS2 P35354 2/20 0.31
▸ ABCB1 P08183 2/20 0.31
▸ ABCC1 P33527 1/20 0.31
▸ GRM1 Q13255 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ HTT P42858 1/20 0.31

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
SCHEMBL31337430 0.89 GRM5 (0.36) GRIN2BTTKMAPK1
SCHEMBL31337312 0.86 TTK (0.34) GRIN2BTTKGRM1
SCHEMBL31337213 0.86 TUBB4A (0.38) GRIN2BTTKGRM1
SCHEMBL31337109 0.86 OXTR (0.37) GRIN2BTTKPTGS2ABCB1
SCHEMBL31337217 0.80 TTK (0.32) GRIN2BTTK
SCHEMBL27472791 0.79 GRIN2B (0.34) GRIN2BTP53MAPTTTK
SCHEMBL30962548 0.79 GRIN2B (0.34) GRIN2BTP53MAPTTTK
SCHEMBL31337177 0.78 GRIN2B (0.36) GRIN2B
SCHEMBL27398967 0.77 PAX8 (0.34) CACNA1HTTKABCB1ABCC1MAPK1
SCHEMBL27473097 0.77 TTK (0.35) GRIN2BTTKMAPK1

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
EP-4747241-A1 BENZIMIDAZOLE DERIVATIVES Syngenta Crop Protection AG (CH) 2026-05-27 — — EP disclosed
WO-2025021537-A1 BENZIMIDAZOLE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2025-01-30 — — WO disclosed
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