SCHEMBL14940656

SCHEMBL14940656

CNc1cccc(OB(O)O)c1O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 3/20 0.35
HSD17B10 Q99714 3/20 0.35
MAPT P10636 3/20 0.35
MAPK1 P28482 3/20 0.35
HPGD P15428 2/20 0.35
LMNA P02545 2/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
ALOX12 P18054 1/20 0.35
POLB P06746 2/20 0.34
ATM Q13315 1/20 0.34
TLR2 O60603 1/20 0.33
ERN1 O75460 1/20 0.33
TLR1 Q15399 1/20 0.33
TLR6 Q9Y2C9 1/20 0.33
APP P05067 3/20 0.33
IDO1 P14902 1/20 0.32
CYP2D6 P10635 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
SCHEMBL27764590 0.82 APP (0.42) ALDH1A1KDM4EHSD17B10MAPTMAPK1
SCHEMBL27984949 0.76 ALDH1A1 (0.54) ALDH1A1KDM4EHSD17B10MAPTMAPK1
SCHEMBL8594043 0.76 LMNA (0.54) ALDH1A1KDM4EHSD17B10MAPTMAPK1
SCHEMBL11138990 0.75 IDO1 (0.44) ALDH1A1KDM4EHSD17B10MAPTMAPK1
Boric Acid SCHEMBL14940655 0.72 HPGD (0.46) ALDH1A1KDM4EHSD17B10MAPTMAPK1
SCHEMBL31112249 0.71 ERN1 (0.44) ALDH1A1KDM4EHSD17B10MAPTMAPK1
SCHEMBL28291056 0.71 ERN1 (0.44) ALDH1A1KDM4EHSD17B10MAPTMAPK1
SCHEMBL9187029 0.71 MMP2 (0.39) ALDH1A1KDM4EHSD17B10MAPTMAPK1
SCHEMBL17602712 0.71 TSHR (0.37) ALDH1A1KDM4EHSD17B10MAPTMAPK1
SCHEMBL8594015 0.70 CA2 (0.57) ALDH1A1KDM4EHSD17B10MAPTMAPK1

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-20140193587-A1 METHODS OF TREATING WOOD WITH PRESERVATIVES USING SUPERCRITICAL NOBLE GASES EMPIRE TECHNOLOGY DEVELOPMENT LLC 2014-07-10 US disclosed
WO-2013070196-A2 METHODS OF TREATING WOOD WITH PRESERVATIVES USING SUPERCRITICAL NOBLE GASES EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2013-05-16 WO disclosed