SCHEMBL26545860

SCHEMBL26545860

COc1cccc(CNc2ccc(SNc3nccs3)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.47
MAPT P10636 3/20 0.46
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 3/20 0.45
GAA P10253 3/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ALOX12 P18054 2/20 0.44
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
NPC1 O15118 1/20 0.43
ALOX15 P16050 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
EGFR P00533 1/20 0.42

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
SCHEMBL30855010 0.83 ALDH1A1 (0.55) MAPTALDH1A1KDM4EGAAPDE4A
SCHEMBL26545931 0.81 ALDH1A1 (0.48) MAPTALDH1A1KDM4EGAAMEN1
SCHEMBL26546033 0.81 ALOX12 (0.67) ALDH1A1GAAMEN1KMT2AALOX12
SCHEMBL16646057 0.79 ALOX12 (0.69) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL26545834 0.77 GAA (0.71) MAPTALDH1A1KDM4EGAAMEN1
SCHEMBL26545970 0.73 ALOX12 (0.51) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL30854961 0.72 HIF1A (0.59) HIF1AMAPTALDH1A1KDM4EGAA
SCHEMBL26545845 0.72 MAPT (0.47) HIF1AMAPTALDH1A1KDM4EGAA
SCHEMBL26545899 0.72 ILK (0.44) MAPTALDH1A1KDM4EGAAKMT2A
SCHEMBL30854977 0.71 ROCK2 (0.49) ALDH1A1KDM4EGAANPC1RAB9A

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