SCHEMBL18658472

SCHEMBL18658472

O=C(O)C(O)C(=O)Oc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
ELANE P08246 3/20 0.46
TDP1 Q9NUW8 2/20 0.44
SLC1A3 P43003 1/20 0.43
ALOX15 P16050 2/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
LMNA P02545 2/20 0.41
MAPK1 P28482 1/20 0.41
MAPT P10636 2/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HSP90AA1 P07900 1/20 0.40
GAA P10253 1/20 0.40
NSD2 O96028 1/20 0.40
CYP2D6 P10635 1/20 0.38
SRC P12931 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
SCHEMBL526418 0.82 ATM (0.53) ATML3MBTL1ELANETDP1SLC1A3
SCHEMBL4191464 0.82 ATM (0.58) ATML3MBTL1ELANETDP1SLC1A3
SCHEMBL13517020 0.82 ATM (0.53) ATML3MBTL1ELANETDP1SLC1A3
SCHEMBL526417 0.81 ATM (0.49) ATML3MBTL1ELANETDP1SLC1A3
SCHEMBL12884247 0.80 ATM (0.52) ATML3MBTL1ELANETDP1SLC1A3
SCHEMBL6554232 0.80 ATM (0.52) ATML3MBTL1ELANETDP1SLC1A3
SCHEMBL10193267 0.80 ATM (0.52) ATML3MBTL1ELANETDP1SLC1A3
SCHEMBL28693937 0.80 ATM (0.52) ATML3MBTL1ELANETDP1SLC1A3
SCHEMBL31086956 0.79 ATM (0.55) ATML3MBTL1ELANETDP1SLC1A3
SCHEMBL10443268 0.78 ATM (0.50) ATML3MBTL1ELANETDP1SLC1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3145019-A1 NON-AQUEOUS ELECTROLYTE, POWER STORAGE DEVICE USING SAME, AND LITHIUM SALT USED FOR SAME UBE Industries, Ltd. (JP) 2017-03-22 EP disclosed