SCHEMBL4288694

SCHEMBL4288694

[O-][Cl+3]([O-])([O-])Oc1ccc2cccc3c4cccc5cccc(c1c23)c54

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.47
ALDH1A1 P00352 3/20 0.47
HPGD P15428 3/20 0.47
HSD17B10 Q99714 3/20 0.47
THRB P10828 1/20 0.47
ERBB2 P04626 1/20 0.39
FYN P06241 1/20 0.39
MAOA P21397 1/20 0.39
ACHE P22303 1/20 0.39
AHR P35869 1/20 0.39
CYP3A4 P08684 2/20 0.34
TSHR P16473 2/20 0.34
CYP1A1 P04798 1/20 0.34
CYP1B1 Q16678 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPT P10636 1/20 0.32

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
SCHEMBL4564700 0.79 ALDH1A1 (0.56) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL4406270 0.76 HPGD (0.52) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL28190216 0.72 IDO1 (0.47) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL4080090 0.71 ALDH1A1 (0.47) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL2585748 0.71 ALDH1A1 (0.47) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL6516074 0.71 CYP1A2 (0.52) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL781876 0.71 HPGD (0.47) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL22436248 0.71 CYP1A2 (0.47) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL27553479 0.71 ALDH1A1 (0.47) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL8740451 0.71 CYP1A2 (0.49) CYP1A2ALDH1A1HPGDHSD17B10THRB

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-20090111030-A1 POWER STORAGE DEVICE PANASONIC INTELLECTUAL PROPERTY MANAGEMENT CO., LTD. (JP) 2009-04-30 US disclosed
EP-2023427-A1 STORAGE DEVICE Panasonic Corporation (JP) 2009-02-11 EP disclosed