SCHEMBL31160364

SCHEMBL31160364

O=[N+]([O-])c1cccc(CSc2nnc(Cn3c4ccccc4c4ccccc43)n2-c2ccccc2)c1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.54
▸ SIRT2 Q8IXJ6 3/20 0.52
▸ L3MBTL1 Q9Y468 3/20 0.52
▸ POLB P06746 1/20 0.52
▸ RXFP1 Q9HBX9 1/20 0.52
▸ MAPT P10636 4/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ BCL2 P10415 1/20 0.48
▸ LMNA P02545 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ PTK2 Q05397 1/20 0.44

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
SCHEMBL31160341 0.89 SIRT2 (0.66) ALDH1A1SIRT2MAPTSMN1; SMN2LMNA
SCHEMBL31160388 0.84 SIRT2 (0.58) ALDH1A1SIRT2MAPTSMN1; SMN2LMNA
SCHEMBL31160351 0.83 ALDH1A1 (0.51) ALDH1A1SIRT2MAPTLMNAKMT2A
SCHEMBL31160442 0.83 ALDH1A1 (0.50) ALDH1A1SIRT2SMN1; SMN2LMNAKMT2A
SCHEMBL31160437 0.83 SIRT2 (0.64) ALDH1A1SIRT2MAPTSMN1; SMN2LMNA
SCHEMBL31160451 0.83 GAA (0.62) ALDH1A1SIRT2MAPTLMNAKMT2A
SCHEMBL31160361 0.81 METAP2 (0.52) ALDH1A1SIRT2MAPTSMN1; SMN2PTK2
SCHEMBL31160379 0.80 GAA (0.52) ALDH1A1SIRT2MAPTSMN1; SMN2LMNA
SCHEMBL31160395 0.80 SLC5A1 (0.49) ALDH1A1SIRT2MAPTSMN1; SMN2LMNA
SCHEMBL31160390 0.77 SMN1; SMN2 (0.61) ALDH1A1SIRT2L3MBTL1MAPTSMN1; SMN2

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-119019374-A Carbazole compound for preventing and treating plant pathogenic bacteria, and synthetic method and application thereof 贵州大学 2024-11-26 — — CN claimed
CN-119019374-A Carbazole compound for preventing and treating plant pathogenic bacteria, and synthetic method and application thereof 贵州大学 2024-11-26 — — CN disclosed
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