SCHEMBL3628734

SCHEMBL3628734

CC(=O)C1CCCC(=O)O1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.40
CA9 Q16790 1/20 0.40
CYP2D6 P10635 1/20 0.33
CYP1A2 P05177 2/20 0.31
CREBBP Q92793 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL2859513 0.94 CA1 (0.39) CA1CA9CYP1A2
SCHEMBL12956481 0.87
SCHEMBL274337 0.87
SCHEMBL15116733 0.87
Butyrolactone SCHEMBL7617264 0.82 CA1 (0.44) CA1CA9CYP2D6
SCHEMBL18302606 0.81 CA1 (0.37) CA1CA9CYP2D6SMN1; SMN2
SCHEMBL9846779 0.81 CA1 (0.37) CA1CA9CYP2D6SMN1; SMN2
SCHEMBL16804836 0.79 CA1 (0.36) CA1CA9CYP2D6
SCHEMBL16804841 0.79 CA1 (0.36) CA1CA9CYP2D6
SCHEMBL14249431 0.75 POLB (0.39) CA1CA9SMN1; SMN2

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-7695863-B2 rechargeable batteries having excellent battery cycle properties, electrical capacity and storage characteristic during charging, comprising electrodes and a nonaqueous electrolytic solution containing a dicarbonyl compound as an additive UBE INDUSTRIES, LTD. (JP) 2010-04-13 US disclosed
US-20080102377-A1 rechargeable batteries having excellent battery cycle properties, electrical capacity and storage characteristic during charging, comprising electrodes and a nonaqueous electrolytic solution containing a dicarbonyl compound as an additive UBE INDUSTRIES, LTD (JP) 2008-05-01 US disclosed