SCHEMBL27285263

SCHEMBL27285263

O=NC(c1nc2ccccc2s1)S(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.49
▸ HSD17B10 Q99714 2/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ ALOX5 P09917 1/20 0.45
▸ LOXL2 Q9Y4K0 1/20 0.44
▸ DDAH1 O94760 1/20 0.42
▸ TSHR P16473 2/20 0.42
▸ GAA P10253 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ RAB9A P51151 2/20 0.41
▸ APEX1 P27695 1/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CASR P41180 1/20 0.39
▸ ALOX15 P16050 2/20 0.38
▸ CASP1 P29466 1/20 0.38
▸ PSMB8 P28062 1/20 0.38

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
SCHEMBL1001902 0.80 HPGD (0.57) HPGDHSD17B10CYP1A2CYP2C9CYP2C19
SCHEMBL30943481 0.80 HPGD (0.57) HPGDHSD17B10CYP1A2CYP2C9CYP2C19
SCHEMBL999631 0.78 HPGD (0.51) HPGDHSD17B10CYP1A2CYP2C9CYP2C19
SCHEMBL14413949 0.78 HPGD (0.51) HPGDHSD17B10CYP1A2CYP2C9CYP2C19
SCHEMBL13369306 0.78 LOXL2 (0.54) HPGDHSD17B10CYP1A2CYP2C9CYP2C19
SCHEMBL16218259 0.69 ALOX5 (0.57) HPGDHSD17B10CYP1A2CYP2C9CYP2C19
SCHEMBL27943317 0.69 HPGD (0.59) HPGDHSD17B10CYP1A2CYP2C9CYP2C19
SCHEMBL6174430 0.68 NPC1 (0.46) HPGDHSD17B10CYP1A2CYP2C19HIF1A
SCHEMBL30052644 0.68 NPC1 (0.46) HPGDHSD17B10CYP1A2CYP2C19HIF1A
SCHEMBL12085830 0.68 HPGD (0.64) HPGDHSD17B10CYP1A2CYP2C9CYP2C19

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-2277597-B2 Reductive colour removal HENKEL AG & CO KGAA (DE) 2024-06-26 — — EP disclosed
Send feedback