SCHEMBL1296451

SCHEMBL1296451

CCOP(=O)(CC)OC(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
TSHR P16473 3/20 0.47
LMNA P02545 3/20 0.46
MAPT P10636 2/20 0.44
MAPK1 P28482 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
NPC1 O15118 1/20 0.44
GAA P10253 1/20 0.44
RAB9A P51151 1/20 0.44
POLB P06746 3/20 0.42
F2 P00734 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
NR1I2 O75469 1/20 0.41
KCNH2 Q12809 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HIF1A Q16665 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL9333329 0.83 MEN1 (0.53) KMT2AMEN1TSHRLMNAMAPK1
SCHEMBL7738531 0.82 TSHR (0.44) KMT2AMEN1TSHRLMNAMAPT
SCHEMBL27610133 0.81 TSHR (0.53) KMT2AMEN1TSHRLMNAMAPT
SCHEMBL17978143 0.80 TSHR (0.65) KMT2AMEN1TSHRLMNAMAPT
SCHEMBL14981920 0.79 TSHR (0.49) KMT2AMEN1TSHRLMNAMAPT
SCHEMBL28831737 0.79 MEN1 (0.49) KMT2AMEN1TSHRLMNASMN1; SMN2
SCHEMBL28169668 0.79 MEN1 (0.56) KMT2AMEN1TSHRLMNAMAPK1
SCHEMBL29108959 0.78 LMNA (0.60) KMT2AMEN1TSHRLMNAMAPT
SCHEMBL11827967 0.76 TSHR (0.58) KMT2AMEN1TSHRLMNAMAPT
SCHEMBL1305579 0.76 POLB (0.59) KMT2AMEN1TSHRLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110265605-A1 METHODS OF PRODUCING AND RECOVERING PLUTONIUM-238 BATTELLE ENERGY ALLIANCE, LLC (US) 2011-11-03 US disclosed
US-5475129-A Phosphonoalkyl phenylalanine compounds suitably protected for use in peptide synthesis THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1995-12-12 US disclosed
WO-1993025561-A1 PHOSPHONOALKYL PHENYLALANINE COMPOUNDS SUITABLY PROTECTED FOR USE IN PEPTIDE SYNTHESIS THE GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1993-12-23 WO disclosed
EP-0275147-B1 IMPROVEMENTS IN OR RELATING TO PRINTING PLATE PRECURSORS E.I. du Pont de Nemours and Company (US) 1993-06-16 EP disclosed
US-4942111-A Printing plate precursors VICKERS PLC (GB) 1990-07-17 US disclosed
EP-0275147-A2 Improvements in or relating to printing plate precursors E.I. du Pont de Nemours and Company (US) 1988-07-20 EP disclosed