SCHEMBL3403560

SCHEMBL3403560

O=P([O-])([O-])c1ccccc1F.[Cu+2]

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.34
CES1 P23141 2/20 0.34
GAA P10253 2/20 0.33
ACHE P22303 1/20 0.33
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
TDP1 Q9NUW8 1/20 0.32
ALDH1A1 P00352 2/20 0.32
ALOX15 P16050 1/20 0.32
NFE2L2 Q16236 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
NPC1 O15118 2/20 0.31
HPGD P15428 2/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
RAB9A P51151 1/20 0.31
PTPN1 P18031 1/20 0.31
ERCC5 P28715 1/20 0.31
FEN1 P39748 1/20 0.31
MGLL Q99685 1/20 0.30

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
SCHEMBL780295 0.78 ACHE (0.40) CES2CES1GAAACHEMEN1
SCHEMBL777631 0.77 CES2 (0.39) CES2CES1GAAACHEMEN1
SCHEMBL9407116 0.76 CA4 (0.33) MEN1KMT2AALDH1A1GPR84NPC1
SCHEMBL778538 0.73 ACHE (0.40) CES2CES1GAAACHEMEN1
SCHEMBL3889145 0.73 CA2 (0.44) CES2CES1GAAMEN1KMT2A
SCHEMBL3403564 0.71 PTK2B (0.42) CES2CES1GAAMEN1KMT2A
SCHEMBL3398161 0.71 MEN1 (0.31) MEN1KMT2ATDP1MGLL
SCHEMBL780209 0.70 POLB (0.44) GAAMEN1KMT2ATDP1ALDH1A1
SCHEMBL11587238 0.70 CYP1A2 (0.39) CES2CES1GAAMEN1KMT2A
SCHEMBL779902 0.70 CA2 (0.41) GAAMEN1KMT2ATDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461075-B2 Recording material and method of recording TOYO INK MFG. CO., LTD. (JP) 2013-06-11 US disclosed
EP-1800885-B1 RECORDING MATERIAL AND METHOD OF RECORDING TOYO INK MFG CO (JP) 2010-08-11 EP disclosed
US-20080113861-A1 laser coloring layer of pigments, dyes, inorganic materials; foaming agent, urethane binder resin; YAG laser wavelength absorption range of 700 to 12,000 nm; generate gas within recording material, forming convex protrusions; food packaging, Braille, friction, buffering, spacer materials TOKYO INK MFG. CO., LTD. (JP) 2008-05-15 US disclosed
EP-1800885-A1 RECORDING MATERIAL AND METHOD OF RECORDING TOYO INK MFG. CO., LTD. (JP) 2007-06-27 EP disclosed