SCHEMBL16673221

SCHEMBL16673221

CC(CCc1ccccc1)COC(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.56
KMT2A Q03164 3/20 0.53
TDP1 Q9NUW8 2/20 0.53
SLC6A2 P23975 1/20 0.53
SLC6A3 Q01959 1/20 0.53
MAPT P10636 1/20 0.53
ADRB2 P07550 2/20 0.52
ADRB1 P08588 2/20 0.52
ADRB3 P13945 2/20 0.52
HPGD P15428 1/20 0.51
RAB9A P51151 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ESR1 P03372 1/20 0.49
ESR2 Q92731 1/20 0.49
MEN1 O00255 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
HTT P42858 1/20 0.48
NPC1 O15118 1/20 0.48
LMNA P02545 2/20 0.47
TSHR P16473 1/20 0.46

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
SCHEMBL571219 0.85 ALDH1A1 (0.69) ALDH1A1KMT2ATDP1SLC6A2SLC6A3
SCHEMBL17629341 0.84 ALDH1A1 (0.59) ALDH1A1KMT2ATDP1SLC6A2SLC6A3
SCHEMBL28756848 0.84 ALDH1A1 (0.64) ALDH1A1KMT2ATDP1SLC6A2SLC6A3
SCHEMBL14770230 0.84 MAPT (0.59) ALDH1A1KMT2ATDP1SLC6A2SLC6A3
SCHEMBL28942313 0.84 ALDH1A1 (0.64) ALDH1A1KMT2ATDP1SLC6A2SLC6A3
SCHEMBL27960474 0.83 ALDH1A1 (0.57) ALDH1A1KMT2ATDP1SLC6A2SLC6A3
SCHEMBL16673089 0.82 ALDH1A1 (0.54) ALDH1A1KMT2ATDP1SLC6A2SLC6A3
SCHEMBL28875159 0.81 MAPT (0.56) ALDH1A1KMT2ATDP1SLC6A2SLC6A3
SCHEMBL5697802 0.81 ALDH1A1 (0.56) ALDH1A1KMT2ATDP1SLC6A2SLC6A3
SCHEMBL7296875 0.80 ALDH1A1 (0.62) ALDH1A1KMT2ATDP1SLC6A2SLC6A3

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
EP-2869389-B1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTIC SOLUTION CELL USING SAME MITSUBISHI CHEM CORP (JP) 2019-11-13 EP disclosed
US-10320030-B2 Nonaqueous electrolyte solution and nonaqueous electrolyte battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2019-06-11 US disclosed
US-20150140448-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2015-05-21 US disclosed
EP-2869389-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTIC SOLUTION CELL USING SAME Mitsubishi Chemical Corporation (JP) 2015-05-06 EP disclosed