SCHEMBL29111182

SCHEMBL29111182

[N-]=[N+]=Nc1ccccc1N[SH](=O)=O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ F2R P25116 1/20 0.32

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
SCHEMBL27851787 0.73 GAA (0.44) F2R
SCHEMBL30858726 0.72 GABRA1 (0.34) F2R
SCHEMBL27630601 0.72 GABRA1 (0.34) F2R
SCHEMBL23016006 0.72 SMN1; SMN2 (0.33) —
SCHEMBL27837436 0.72 CYP3A4 (0.44) —
SCHEMBL21631846 0.71 GABRA1 (0.31) F2R
SCHEMBL28573435 0.70 KAT2B (0.39) —
SCHEMBL20609988 0.68 HSD17B10 (0.49) —
SCHEMBL23091564 0.67 GABRA1 (0.33) F2R
SCHEMBL25298603 0.67 LMNA (0.39) F2R

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
CN-115636817-B Isatin derivative containing triazole ring, and preparation method and application thereof 山东大学 2023-11-24 — — CN disclosed
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