SCHEMBL15438474

SCHEMBL15438474

CC#CC(CC)(C(=O)O)P(=O)(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
TSHR P16473 2/20 0.39
ALDH1A1 P00352 2/20 0.39
GAA P10253 2/20 0.39
PKM P14618 1/20 0.39
USP2 O75604 1/20 0.36
ESR1 P03372 1/20 0.36
POLB P06746 2/20 0.35
CFTR P13569 1/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
CA5A P35218 1/20 0.33

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
SCHEMBL15438732 0.78 ALDH1A1 (0.41) ALDH1A1LMNA
SCHEMBL15438679 0.76 TSHR (0.40) KDM4EMEN1KMT2ATSHRALDH1A1
SCHEMBL15438461 0.74
SCHEMBL15438480 0.74 KDM4E (0.40) KDM4EMEN1KMT2ATSHRALDH1A1
SCHEMBL15438083 0.73
SCHEMBL15438224 0.70
SCHEMBL6050594 0.67 MEN1 (0.56) KDM4EMEN1KMT2ATSHRALDH1A1
SCHEMBL15438982 0.67 TSHR (0.35) TSHR
SCHEMBL20783528 0.64 ALDH1A1 (0.49) KDM4EMEN1KMT2ATSHRALDH1A1
SCHEMBL6050587 0.62 ALDH1A1 (0.59) KDM4EMEN1KMT2ATSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2698859-B1 NON-AQUEOUS ELECTROLYTIC SOLUTION AND ELECTRICITY-STORAGE DEVICE USING THE SAME UBE INDUSTRIES (JP) 2016-07-27 EP disclosed
US-9384906-B2 Non-aqueous electrolyte solution and electricity-storage device using same UBE INDUSTRIES, LTD. (JP) 2016-07-05 US disclosed
CN-103460495-B Nonaqueous electrolytic solution and employ the electric energy storage device of this nonaqueous electrolytic solution UBE INDUSTRIES, LTD. (JP) 2016-01-27 CN disclosed
EP-2698859-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY-STORAGE DEVICE USING SAME Ube Industries, Ltd. (JP) 2014-02-19 EP disclosed
US-20140030610-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY-STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD (JP) 2014-01-30 US disclosed