SCHEMBL16865163

SCHEMBL16865163

CC1CC1C(=O)OCCOC(=O)OCCOC(=O)C1(C#N)CC1C

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL16865154 0.84 ALDH1A1 (0.32)
SCHEMBL16865199 0.78 NPSR1 (0.30)
SCHEMBL16865183 0.76 NAAA (0.32)
SCHEMBL16865161 0.73 POLB (0.42) POLBKDM4ENPC1RAB9A
SCHEMBL5435193 0.73 ALDH1A1 (0.36) POLBKDM4ERAB9A
SCHEMBL14435631 0.73 ALDH1A1 (0.36) POLBKDM4ERAB9A
SCHEMBL16865165 0.67 JAK2 (0.31) RAB9A
SCHEMBL10073885 0.66 CTSK (0.33)
SCHEMBL16865175 0.66 PRKCA (0.31)
SCHEMBL298981 0.65 L3MBTL1 (0.44) POLBKDM4ENPC1RAB9A

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
US-20150188193-A1 NON-AQUEOUS LIQUID ELECTROLYTE FOR SECONDARY BATTERY AND SECONDARY BATTERY FUJIFILM CORPORATION (JP) 2015-07-02 US disclosed