SCHEMBL28933142

SCHEMBL28933142

C=CCOCC=C(C)C=O

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
KMT2A Q03164 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL11730263 0.77
SCHEMBL11731268 0.77
SCHEMBL6905712 0.77
Acetic Acid SCHEMBL131569 0.74 FFAR3 (0.39) MEN1POLBKMT2ACA1CA2
Formic Acid SCHEMBL951745 0.73 CA1 (0.41) MEN1POLBKMT2ACA1CA2
Methyl Alcohol SCHEMBL6673394 0.72
SCHEMBL465995 0.72 TDP1 (0.33) MEN1POLBKMT2ACA1CA2
Acetic Acid SCHEMBL667791 0.72 TDP1 (0.37) MEN1POLBKMT2ACA1CA2
SCHEMBL6925260 0.72
SCHEMBL11597959 0.72

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
CN-114044790-B Hexacarbon phosphonate, preparation method thereof and preparation method of vitamin A ester 广州立达尔生物科技股份有限公司 2023-11-17 CN disclosed
CN-114044790-A Six-carbon phosphate and preparation method thereof, and preparation method of vitamin A esterified substance 广州立达尔生物科技股份有限公司 2022-02-15 CN disclosed