SCHEMBL31468708

SCHEMBL31468708

Cn1c(=S)n(C)c(=O)n(-c2cc(C3=NOC(C)(C(=O)OCc4ccccc4)CC3)c(Cl)cc2F)c1=O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 2/20 0.32
▸ DDB1 Q16531 1/20 0.31
▸ CRBN Q96SW2 1/20 0.31
▸ ITGB1 P05556 1/20 0.31
▸ ITGA4 P13612 1/20 0.31
▸ GPBAR1 Q8TDU6 1/20 0.30
▸ GRM5 P41594 1/20 0.30
▸ CA1 P00915 1/20 0.30
▸ CA2 P00918 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
SCHEMBL31468675 0.89 PPOX (0.30) —
SCHEMBL31468695 0.88 PPOX (0.30) —
SCHEMBL31468676 0.87 — —
SCHEMBL31468670 0.86 CA1 (0.30) CA1CA2
SCHEMBL31468697 0.86 — —
SCHEMBL31468722 0.85 — —
SCHEMBL31468699 0.85 — —
SCHEMBL31468711 0.84 — —
SCHEMBL31468701 0.84 — —
SCHEMBL31468677 0.82 PPOX (0.30) —

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-119661458-A N-phenyl triazinone derivative and preparation method and application thereof 贵州大学 2025-03-21 — — CN claimed
CN-119661458-A N-phenyl triazinone derivative and preparation method and application thereof 贵州大学 2025-03-21 — — CN disclosed
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