SCHEMBL4613089

SCHEMBL4613089

CC(=O)[C@@H]1C=C[C@H](C(C)=O)C1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL4613099 1.00 POLB (0.32) POLBAPEX1TDP1
SCHEMBL1786518 0.84
SCHEMBL15215794 0.82
SCHEMBL27546517 0.80 POLB (0.36) POLBTDP1
SCHEMBL13953760 0.78
SCHEMBL23809950 0.77
SCHEMBL1784820 0.73 ABAT (0.31)
SCHEMBL14944290 0.71 ABAT (0.31)
SCHEMBL12491781 0.71 POLB (0.42) POLBAPEX1TDP1
SCHEMBL1782951 0.71 POLB (0.31) POLBAPEX1TDP1

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-1428888-B1 Method for the production of (1S,4R)-(-)-4-Hydroxycyclopent-2-enyl esters ARCHIMICA GMBH (DE) 2008-10-22 EP claimed