SCHEMBL28902249

SCHEMBL28902249

C1COCO1.COCCOCCOCCOCCOC

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.33

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
SCHEMBL3743823 0.92
Dioxane SCHEMBL8149387 0.89 CA2 (0.35) CA2
Dioxane SCHEMBL10324821 0.89 CA2 (0.35) CA2
Dioxane SCHEMBL3104036 0.89 CA2 (0.35) CA2
SCHEMBL27827807 0.81 TSHR (0.33)
SCHEMBL4625372 0.80 TTR (0.43)
Dioxane SCHEMBL2949971 0.80 TTR (0.43)
Fluoride SCHEMBL29177050 0.80 CA2 (0.42) CA2
Fluoride SCHEMBL27913771 0.80 CA2 (0.42) CA2
Fluoride SCHEMBL27932024 0.80 CA2 (0.42) CA2

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
CN-110023275-B Battery based on organic sulfur substances 阿科玛股份有限公司 2022-11-29 CN disclosed