SCHEMBL3883053

SCHEMBL3883053

Cc1ccc(C2CCCCC2F)c(C2CCCCC2F)c1P(=O)(O)O

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.30
PDK1 Q15118 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
SCHEMBL777634 0.80 TAS1R3 (0.31)
SCHEMBL777096 0.80 SNCA (0.31) SNCAPDK1
SCHEMBL777003 0.77 NPC1 (0.36)
SCHEMBL3896285 0.77 NPC1 (0.31)
SCHEMBL3883051 0.75
SCHEMBL776625 0.72 NPC1 (0.35)
SCHEMBL776624 0.65 TAS1R3 (0.36)
SCHEMBL31031192 0.65 TSHR (0.40) SNCAPDK1
SCHEMBL1552134 0.65 TSHR (0.40) SNCAPDK1
SCHEMBL777633 0.64 TAS1R3 (0.33)

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-20090325065-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2009-12-31 US disclosed