SCHEMBL13618804

SCHEMBL13618804

C1CCCCCCCC(=C2CC2)OCCCCCC1

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.42
CA9 Q16790 1/20 0.42

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
SCHEMBL8167473 1.00 CA1 (0.42) CA1CA9
SCHEMBL4053506 0.94 CA1 (0.42) CA1CA9
SCHEMBL4053501 0.94 CA1 (0.42) CA1CA9
SCHEMBL3817016 0.94 CA1 (0.42) CA1CA9
SCHEMBL1387069 0.94 CA1 (0.42) CA1CA9
SCHEMBL2034105 0.89 CA1 (0.36) CA1CA9
SCHEMBL12806281 0.86 CA1 (0.38) CA1CA9
SCHEMBL3294701 0.83 ALDH1A1 (0.32) CA1CA9
SCHEMBL12796573 0.82 CA1 (0.50) CA1CA9
SCHEMBL2668138 0.80

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
EP-2116608-A2 Polyester synthesis Xerox Corporation (US) 2009-11-11 EP disclosed