SCHEMBL26547012

SCHEMBL26547012

O=S(=O)(Nc1nc2ccccc2s1)c1ccc(NCc2cccc(O)c2O)cc1

nearest known ligand 0.82

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX12 P18054 18/20 0.82
ALOX15 P16050 5/20 0.82
ALDH1A1 P00352 2/20 0.53
LMNA P02545 1/20 0.52
GAA P10253 1/20 0.52
MAPK1 P28482 1/20 0.52

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
SCHEMBL21504007 0.90 ALOX12 (0.79) ALOX12ALOX15ALDH1A1LMNAGAA
SCHEMBL16646138 0.90 ALOX12 (1.00) ALOX12ALOX15ALDH1A1
SCHEMBL26547049 0.88 ALOX12 (0.70) ALOX12ALOX15ALDH1A1
Vlx-1005 SCHEMBL29598551 0.88 ALOX12 (1.00) ALOX12ALOX15ALDH1A1LMNAGAA
Vlx-1005 SCHEMBL16646023 0.88 ALOX12 (1.00) ALOX12ALOX15ALDH1A1LMNAGAA
SCHEMBL18356857 0.83 ALOX12 (1.00) ALOX12ALOX15ALDH1A1
SCHEMBL16646071 0.83 ALOX12 (0.79) ALOX12ALOX15ALDH1A1
SCHEMBL26547018 0.78 ALOX12 (0.78) ALOX12ALOX15
SCHEMBL16634463 0.77 ALOX12 (1.00) ALOX12ALOX15ALDH1A1LMNAGAA
SCHEMBL30891484 0.77 ALOX12 (1.00) ALOX12ALOX15ALDH1A1LMNAGAA

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
EP-3054936-B1 4-((2-HYDROXY-3-METHOXYBENZYL)AMINO) BENZENESULFONAMIDE DERIVATIVES AS 12-LIPOXYGENASE INHIBITORS EASTERN VIRGINIA MEDICAL SCHOOL (US) 2023-10-18 EP disclosed