SCHEMBL11046075

SCHEMBL11046075

CCOP(=O)(OCC)C(O)c1cccc(Oc2ccccc2)c1

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.70
PTGS1 P23219 1/20 0.51
GAA P10253 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
MEN1 O00255 1/20 0.47
CYP2D6 P10635 1/20 0.47
KMT2A Q03164 1/20 0.47
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ALOX5 P09917 1/20 0.45
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
CETP P11597 1/20 0.43

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
SCHEMBL11214240 0.84 PTGS1 (0.55) POLBPTGS1MEN1CYP2D6KMT2A
SCHEMBL6756690 0.83 POLB (1.00) POLBGAAL3MBTL1HPGDALOX15
SCHEMBL31232896 0.83 POLB (1.00) POLBGAAL3MBTL1HPGDALOX15
SCHEMBL11047286 0.81 POLB (0.58) POLBGAAL3MBTL1KMT2AHPGD
SCHEMBL8740658 0.79 PGK1 (0.65) PTGS1MEN1CYP2D6KMT2AALOX5
SCHEMBL8959005 0.78 POLB (0.67) POLBGAAL3MBTL1MEN1KMT2A
SCHEMBL12937868 0.78 POLB (0.67) POLBGAAL3MBTL1MEN1KMT2A
SCHEMBL1011551 0.76 MAPK1 (0.60) POLBGAAL3MBTL1HPGDMAPK1
SCHEMBL7166722 0.75 POLB (0.82) POLBGAAL3MBTL1MEN1KMT2A
SCHEMBL7868112 0.75 POLB (0.53) POLBMEN1KMT2AHPGDNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4472577-A CATALYTIC HYDROGENATION OF ALPHA-OXO-PHOSPHONIC ACID ESTERS BAYER AKTIENGESELLSCHAFT (DE) 1984-09-18 US disclosed
EP-0071126-B1 PROCESS FOR THE MANUFACTURE OF ALDEHYDES BAYER AG (DE) 1984-09-12 EP disclosed
US-4471118-A Preparation of aldehydes by heating an α-hydroxyphosphonic acid ester BAYER AKTIENGESELLSCHAFT (DE) 1984-09-11 US disclosed
EP-0071805-A2 Process for the preparation of alpha-hydroxy-phosphonic-acid esters BAYER AG (DE) 1983-02-16 EP disclosed
EP-0071126-A1 Process for the manufacture of aldehydes BAYER AG (DE) 1983-02-09 EP disclosed