Quinoxaline

Quinoxaline

SCHEMBL4436397

O=C1CCCSS1.c1ccc2nccnc2c1

nearest known ligand 0.33

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CISD1 Q9NZ45 2/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
PIK3CD O00329 1/20 0.32
CSNK2A2 P19784 1/20 0.32
MAOB P27338 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
MTOR P42345 1/20 0.32
PIK3CG P48736 1/20 0.32
CLK1 P49759 1/20 0.32
CSNK2B P67870 1/20 0.32
CSNK2A1 P68400 1/20 0.32
DYRK1A Q13627 1/20 0.32
DYRK2 Q92630 1/20 0.32
DYRK1B Q9Y463 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
PTK2B Q14289 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL20980 0.77
SCHEMBL5075382 0.74
Hydrochloric Acid SCHEMBL17701151 0.74
SCHEMBL20641558 0.70
Quinoxaline SCHEMBL6928518 0.67 ALDH1A1 (0.58) MAPTALDH1A1
Quinoxaline SCHEMBL30320908 0.67 ALDH1A1 (0.58) MAPTALDH1A1
Quinoxaline SCHEMBL5315 0.67 ALDH1A1 (0.58) MAPTALDH1A1
Quinoxaline SCHEMBL29355228 0.67 ALDH1A1 (0.58) MAPTALDH1A1
Quinoxaline SCHEMBL28773182 0.65 ALDH1A1 (0.50) NPC1RAB9ATP53MAPTPTK2B
Quinoxaline SCHEMBL19877321 0.65 ALDH1A1 (0.50) NPC1RAB9ATP53MAPTPTK2B

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1799776-A4 MICRONIZED WOOD PRESERVATIVE FORMULATIONS IN ORGANIC CARRIERS OSMOSE INC (US) 2009-05-06 EP disclosed
EP-1799776-A2 MICRONIZED WOOD PRESERVATIVE FORMULATIONS IN ORGANIC CARRIERS Osmose, Inc. (US) 2007-06-27 EP disclosed
WO-2006044831-A2 NON-ALKALINE MICRONIZED WOOD PRESERVATIVE FORMULATIONS OSMOSE, INC. (US) 2006-04-27 WO disclosed
WO-2006044218-A2 MICRONIZED WOOD PRESERVATIVE FORMULATIONS IN ORGANIC CARRIERS OSMOSE, INC. (US) 2006-04-27 WO disclosed