SCHEMBL14969366

SCHEMBL14969366

CCCCS(=O)(=O)OCO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.41
CA1 P00915 10/20 0.38
CA2 P00918 10/20 0.38
HPGD P15428 2/20 0.38
MAPK1 P28482 2/20 0.38
NPC1 O15118 1/20 0.38
S1PR2 O95136 1/20 0.38
S1PR4 O95977 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
XBP1 P17861 1/20 0.38
S1PR1 P21453 1/20 0.38
AGTR1 P30556 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL27910931 0.91 PRKCA (0.49) PRKCACA1CA2HPGDMAPK1
SCHEMBL8827666 0.91 PRKCA (0.49) PRKCACA1CA2HPGDMAPK1
SCHEMBL28477276 0.85
SCHEMBL27965502 0.82 TSHR (0.43) PRKCACA1CA2HPGDMAPK1
SCHEMBL14733223 0.80 CA1 (0.46) PRKCACA1CA2HPGDMAPK1
SCHEMBL2382465 0.80 CA1 (0.42) PRKCACA1CA2HPGDMAPK1
SCHEMBL6115103 0.80 CA1 (0.41) PRKCACA1CA2HPGDMAPK1
SCHEMBL25357393 0.80 CA2 (0.33) CA2
SCHEMBL575400 0.78 CA1 (0.54) CA1CA2HPGDMAPK1NPC1
SCHEMBL576855 0.78 CA1 (0.50) CA1CA2HPGDMAPK1NPC1

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-20150244028-A1 NONAQUEOUS SECONDARY CELL, AND FIRE-RETARDANT AGENT AND ADDITIVE FOR NONAQUEOUS SECONDARY CELL WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2015-08-27 US disclosed
US-20130130128-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY USING SAME WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2013-05-23 US disclosed