SCHEMBL28804202

SCHEMBL28804202

C=CCOCC(CCO)OCC=C

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.39

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
SCHEMBL273134 0.87 CA1 (0.39) CA1CA2CA7CA9
SCHEMBL1072661 0.85 TSHR (0.32) CA1CA2CA7
SCHEMBL4931536 0.83 CA1 (0.45) CA1CA2CA7CA9
SCHEMBL87983 0.83 CA1 (0.45) CA1CA2CA7CA9
SCHEMBL151203 0.83 CA1 (0.48) CA1CA2CA7CA9
SCHEMBL827188 0.82 CA1 (0.41) CA1CA2CA7CA9
SCHEMBL18831991 0.81
SCHEMBL14874421 0.81 CA1 (0.46) CA1CA2CA7CA9
SCHEMBL9779437 0.78 MEN1 (0.34)
SCHEMBL827844 0.77 CA1 (0.37) CA1CA2CA7CA9

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-108349919-B Polyfunctional epoxy compound and curable composition containing the same 日产化学工业株式会社 2022-06-03 CN disclosed