Dioxane

Dioxane

SCHEMBL1995894

C1COCCO1.CC1(C)OB(C2=CCOCC2)OC1(C)C

nearest known ligand 0.93

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.93
▸ P2RX7 Q99572 1/20 0.53
▸ LPL P06858 1/20 0.30
▸ LIPG Q9Y5X9 1/20 0.30

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
SCHEMBL67926 0.96 MAPK1 (1.00) MAPK1P2RX7LPLLIPG
SCHEMBL1995890 0.92 MAPK1 (0.84) MAPK1P2RX7
SCHEMBL23755678 0.86 MAPK1 (0.80) MAPK1P2RX7LPLLIPG
SCHEMBL16679197 0.85 MAPK1 (0.79) MAPK1P2RX7
SCHEMBL20867989 0.84 MAPK1 (0.71) MAPK1P2RX7LPLLIPG
SCHEMBL20697262 0.82 MAPK1 (0.73) MAPK1P2RX7
SCHEMBL22548973 0.82 MAPK1 (0.73) MAPK1P2RX7
SCHEMBL28771140 0.82 MAPK1 (0.72) MAPK1P2RX7
SCHEMBL1586037 0.77 MAPK1 (0.67) MAPK1P2RX7LPLLIPG
SCHEMBL18430042 0.76 MAPK1 (0.65) MAPK1P2RX7

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
EP-2328903-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETASECRETASE MODULATORS AND METHODS OF USE Amgen Inc. (US) 2011-06-08 — — EP disclosed
WO-2010030954-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETASECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2010-03-18 — — WO disclosed
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