Sugi Predict

Sugi Predict / Compounds / Dioxane

Dioxane

Dioxane

SCHEMBL9616478

C1COCCO1.C=C.C=C.C=C.C=C

nearest known ligand 0.75

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 1/20 0.75
▸ ALDH1A1 P00352 1/20 0.46
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ TSHR P16473 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ LMNA P02545 3/20 0.32
▸ SMN1; SMN2 Q16637 3/20 0.32
▸ CRHBP P24387 2/20 0.32
▸ HTT P42858 2/20 0.32
▸ CRHR2 Q13324 2/20 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
Dioxane SCHEMBL16408787 1.00 — —
Dioxane SCHEMBL23500191 1.00 TTR (0.75) TTRALDH1A1MEN1KMT2ATSHR
Oxirane SCHEMBL556548 0.94 — —
Oxirane SCHEMBL1075544 0.88 — —
Oxirane SCHEMBL27339124 0.88 — —
Oxirane SCHEMBL27546246 0.88 — —
Oxirane SCHEMBL27937427 0.88 — —
SCHEMBL11207601 0.87 TTR (1.00) TTRALDH1A1MEN1KMT2ATSHR
SCHEMBL78595 0.87 TTR (1.00) TTRALDH1A1MEN1KMT2ATSHR
SCHEMBL16041435 0.87 TTR (1.00) TTRALDH1A1MEN1KMT2ATSHR

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
US-5164816-A Polyamides, polyimides HITACHI CHEMICAL CO., LTD. (JP) 1992-11-17 — — US disclosed