SCHEMBL27821024

SCHEMBL27821024

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

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.40
LMNA P02545 4/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
TDP1 Q9NUW8 3/20 0.35
MAPT P10636 4/20 0.33
ALDH1A1 P00352 1/20 0.32
RECQL P46063 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
LTA4H P09960 1/20 0.31
USP2 O75604 1/20 0.31
SLCO1B1 Q9Y6L6 1/20 0.31
KDM4E B2RXH2 2/20 0.31

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
SCHEMBL6726577 0.80 PDE4A (0.48) PDE4ALMNAL3MBTL1TDP1MAPT
SCHEMBL28126569 0.78 ALDH1A1 (0.39) PDE4ALMNAL3MBTL1TDP1ALDH1A1
Mannitol SCHEMBL28834478 0.77 PDE4A (0.44) PDE4ALMNAL3MBTL1TDP1MAPT
SCHEMBL29095957 0.75 PDE4A (0.36) PDE4ALMNAL3MBTL1TDP1MAPT
SCHEMBL8124223 0.75 LMNA (0.34) PDE4ALMNAL3MBTL1TDP1MAPT
Biphenyl SCHEMBL27402521 0.74 PDE4A (0.44) PDE4ALMNAL3MBTL1TDP1MAPT
Mannitol SCHEMBL27910852 0.73 KDM4E (0.44) PDE4AL3MBTL1MAPTALDH1A1HPGD
Benzene SCHEMBL28113402 0.72 PDE4A (0.54) PDE4ALMNAL3MBTL1TDP1MAPT
SCHEMBL978754 0.72 LMNA (0.55) LMNAL3MBTL1MAPTALDH1A1RECQL
O-Xylene SCHEMBL28129269 0.71 PDE4A (0.41) PDE4ALMNAL3MBTL1TDP1MAPT

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
CN-102203140-A High melt flow propylene impact copolymer and method DOW GLOBAL TECHNOLOGIES INC (US) 2011-09-28 CN disclosed