SCHEMBL16865199

SCHEMBL16865199

CC1CC1(C#N)C(=O)OCCCOC(=O)C1(C#N)CC1C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 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
SCHEMBL16865183 0.95 NAAA (0.32)
SCHEMBL16865154 0.93 ALDH1A1 (0.32) NPSR1
SCHEMBL5435193 0.84 ALDH1A1 (0.36)
SCHEMBL14435631 0.84 ALDH1A1 (0.36)
SCHEMBL16865163 0.78 POLB (0.34)
SCHEMBL16865165 0.77 JAK2 (0.31)
SCHEMBL16865175 0.76 PRKCA (0.31)
SCHEMBL10073885 0.73 CTSK (0.33)
SCHEMBL24868147 0.70
SCHEMBL4645147 0.70

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