SCHEMBL10766366

SCHEMBL10766366

C=CCOCCC=CC=O

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
TRPA1 O75762 1/20 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
SCHEMBL10766363 1.00 MEN1 (0.36) MEN1POLBKMT2ATRPA1
SCHEMBL3234086 0.79
SCHEMBL3435626 0.77
SCHEMBL2772515 0.73
SCHEMBL23532256 0.71 MEN1 (0.47) MEN1POLBKMT2A
SCHEMBL826355 0.71 MEN1 (0.42) MEN1POLBKMT2A
SCHEMBL29004645 0.71 TSHR (0.37) MEN1POLBKMT2A
SCHEMBL11649541 0.71
SCHEMBL11061202 0.71
SCHEMBL13075249 0.70 TRPA1 (0.37) TRPA1

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
US-4658069-A Conversion of allyl ethers to acetals NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) 1987-04-14 US disclosed
EP-0210453-A1 Conversion of allyl ethers to acetals NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) 1987-02-04 EP disclosed