SCHEMBL27686554

SCHEMBL27686554

O=C(O)C(O)C(O)C(=O)Oc1ccc(O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.40
GAA P10253 3/20 0.39
MAPT P10636 2/20 0.39
XBP1 P17861 1/20 0.39
TSHR P16473 1/20 0.39
P4HB P07237 1/20 0.38
HTT P42858 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
LTA4H P09960 1/20 0.38
NR1H2 P55055 1/20 0.38
BAX Q07812 1/20 0.38
KDM4E B2RXH2 1/20 0.38
GLA P06280 1/20 0.38
THRB P10828 1/20 0.38
BLM P54132 1/20 0.38
CASP6 P55212 1/20 0.38
GFER P55789 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
SCHEMBL689963 0.92 ELANE (0.44) ELANEGAAMAPTXBP1P4HB
SCHEMBL526417 0.84 ATM (0.49) ELANEGAAMAPTTSHRKDM4E
SCHEMBL9854114 0.83 LMNA (0.52) ELANEGAAMEN1KMT2A
SCHEMBL3632858 0.83 LMNA (0.52) ELANEGAAMEN1KMT2A
SCHEMBL4322254 0.83 LMNA (0.52) ELANEGAAMEN1KMT2A
Cadaverine Tartrate SCHEMBL28066769 0.81 TSHR (0.59) MAPTTSHRHTTMEN1KMT2A
Lactic Acid SCHEMBL28390778 0.79 ELANE (0.46) ELANEGAAMAPTXBP1P4HB
SCHEMBL27705573 0.79 CYP3A4 (0.54) MEN1KMT2AESR1ESR2KDM4E
SCHEMBL19331475 0.78 PTGS2 (0.51) GAAMAPTHTTMEN1KMT2A
SCHEMBL526418 0.77 ATM (0.53) ELANEMAPTKDM4ETDP1

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
CN-101076457-B Pneumatic tire BRIDGESTONE CORP 2011-07-27 CN disclosed
CN-101076457-A Pneumatic tire BRIDGESTONE CORP (JP) 2007-11-21 CN disclosed