SCHEMBL3402844

SCHEMBL3402844

COc1ccc(P(=O)(O)O)cc1.[Cu]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.50
CA1 P00915 7/20 0.50
CA12 O43570 2/20 0.50
CA9 Q16790 2/20 0.50
CA14 Q9ULX7 2/20 0.50
CA7 P43166 1/20 0.50
ACP3 P15309 1/20 0.48
PARP10 Q53GL7 2/20 0.48
PARP1 P09874 1/20 0.48
PARP2 Q9UGN5 1/20 0.48
PARP4 Q9UKK3 1/20 0.48
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
CA4 P22748 1/20 0.46
CA5A P35218 1/20 0.46
PLK1 P53350 1/20 0.45
MMP2 P08253 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42

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
SCHEMBL233806 0.98 CA2 (0.52) CA2CA1CA12CA9CA14
Hydrochloric Acid SCHEMBL5561013 0.95 CA2 (0.50) CA2CA1CA12CA9CA14
SCHEMBL8388495 0.91 LTA4H (0.54) CA2CA1CA12CA9CA14
Hydrochloric Acid SCHEMBL28980214 0.90 ESR2 (0.52) CA2CA1CA12CA9CA14
SCHEMBL31609274 0.86 ACP3 (0.42) CA2CA1CA12CA9CA14
SCHEMBL226112 0.84 LMNA (0.56) CA2CA1CA12CA9CA14
SCHEMBL18417835 0.82 CA1 (0.50) CA2CA1CA12CA9CA14
Hydrochloric Acid SCHEMBL20873432 0.80 LMNA (0.52) CA2CA1CA12CA9CA14
SCHEMBL18417833 0.80 CA1 (0.48) CA2CA1CA12CA9CA14
SCHEMBL1618715 0.78 CA1 (0.49) CA2CA1CA12CA9CA14

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