SCHEMBL2945345

SCHEMBL2945345

CCCCCCCOC(=O)/C=C/C=C/C(=O)OCCCCCCC

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.72
ATM Q13315 1/20 0.69
NAAA Q02083 1/20 0.55
TSHR P16473 4/20 0.53
HPGD P15428 1/20 0.53
APP P05067 4/20 0.53
EPHX1 P07099 1/20 0.52
MAPT P10636 1/20 0.51
RAB9A P51151 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
HTT P42858 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 1/20 0.48
CYP3A4 P08684 1/20 0.48

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
SCHEMBL2941965 1.00 HCAR2 (0.72) HCAR2ATMNAAATSHRHPGD
SCHEMBL2941209 1.00 HCAR2 (0.72) HCAR2ATMNAAATSHRHPGD
SCHEMBL2946404 1.00 HCAR2 (0.72) HCAR2ATMNAAATSHRHPGD
SCHEMBL2945349 1.00 HCAR2 (0.72) HCAR2ATMNAAATSHRHPGD
SCHEMBL2947222 1.00 HCAR2 (0.72) HCAR2ATMNAAATSHRHPGD
SCHEMBL2946401 1.00 HCAR2 (0.72) HCAR2ATMNAAATSHRHPGD
SCHEMBL2941846 1.00 HCAR2 (0.72) HCAR2ATMNAAATSHRHPGD
SCHEMBL2941845 1.00 HCAR2 (0.72) HCAR2ATMNAAATSHRHPGD
SCHEMBL2941967 1.00 HCAR2 (0.72) HCAR2ATMNAAATSHRHPGD
SCHEMBL2941212 1.00 HCAR2 (0.72) HCAR2ATMNAAATSHRHPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7727677-B2 Nonaqueous electrolyte solution and lithium secondary battery using same UBE INDUSTRIES, LTD. (JP) 2010-06-01 US disclosed
EP-1758198-B1 NON-AQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME UBE INDUSTRIES (JP) 2009-07-08 EP disclosed
US-20080038644-A1 Nonaques Electrolyte Solution And Lithium Secondary Battery Using Same UBE INDUSTRIES, LTD. (JP) 2008-02-14 US disclosed
EP-1758198-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME Ube Industries, Ltd. (JP) 2007-02-28 EP disclosed