SCHEMBL31337217

SCHEMBL31337217

COC(=O)Nc1ccc(-n2cnc3c(C)cc(C4=NOCCN4c4ccc(F)c(OC)c4)cc32)cn1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 9/20 0.32
▸ RAF1 P04049 2/20 0.32
▸ BRAF P15056 2/20 0.32
▸ GRIN2B Q13224 5/20 0.32
▸ SIK1 P57059 1/20 0.31
▸ SIK2 Q9H0K1 1/20 0.31
▸ SIK3 Q9Y2K2 1/20 0.31
▸ ROCK2 O75116 2/20 0.30
▸ BACE1 P56817 1/20 0.30
▸ BACE2 Q9Y5Z0 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
SCHEMBL31337168 0.90 GRIN2B (0.34) TTKGRIN2B
SCHEMBL31337213 0.81 TUBB4A (0.38) TTKGRIN2B
SCHEMBL31337312 0.81 TTK (0.34) TTKGRIN2B
SCHEMBL31337109 0.80 OXTR (0.37) TTKGRIN2B
SCHEMBL31337239 0.80 GRIN2B (0.33) TTKGRIN2B
SCHEMBL31051254 0.79 PIK3CA (0.38) TTKRAF1BRAFGRIN2BROCK2
SCHEMBL27399768 0.79 PIK3CA (0.38) TTKRAF1BRAFGRIN2BROCK2
SCHEMBL31051204 0.77 PIK3CA (0.47) TTKSIK1SIK2SIK3
SCHEMBL27398807 0.77 PIK3CA (0.47) TTKSIK1SIK2SIK3
SCHEMBL30962548 0.74 GRIN2B (0.34) TTKGRIN2B

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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