SCHEMBL5962080

SCHEMBL5962080

CCC1CCC2(OCCCO2)OC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 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
SCHEMBL4866529 0.71
SCHEMBL21321128 0.69 KDM4E (0.40) POLBKDM4EALDH1A1GAAHPGD
SCHEMBL20688093 0.69 KDM4E (0.40) POLBKDM4EALDH1A1GAAHPGD
SCHEMBL22273200 0.69 KDM4E (0.40) POLBKDM4EALDH1A1GAAHPGD
SCHEMBL19011971 0.67 POLB (0.34) POLBKDM4EALDH1A1GAAHPGD
SCHEMBL18753820 0.65 POLB (0.30) POLB
SCHEMBL24325732 0.64 KDM4E (0.42) POLBKDM4EALDH1A1GAAHPGD
SCHEMBL87245 0.64 POLB (0.42) POLBKDM4EALDH1A1GAAHPGD
SCHEMBL13381234 0.64 PABPC1 (0.37) POLBGAA
SCHEMBL13381240 0.64 PABPC1 (0.33) POLBGAA

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
WO-2006101779-A2 NON-AQUEOUS ELECTROLYTES FOR LITHIUM ION BATTERIES THE UNIVERSITY OF CHICAGO (US) 2006-09-28 WO claimed