SCHEMBL9136992

SCHEMBL9136992

CCOP(=O)(OCC)C(O)c1ccc(C=O)cc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.66
GAA P10253 4/20 0.63
L3MBTL1 Q9Y468 1/20 0.50
ALDH1A1 P00352 2/20 0.43
TYR P14679 1/20 0.43
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
CCNT1 O60563 1/20 0.40
CDK9 P50750 1/20 0.40
NPC1 O15118 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
SCHEMBL7166722 0.88 POLB (0.82) POLBGAAL3MBTL1ALDH1A1HPGD
SCHEMBL9136989 0.84 POLB (0.46) POLBGAAL3MBTL1ALDH1A1TYR
SCHEMBL9713112 0.81 POLB (0.72) POLBGAAL3MBTL1ALDH1A1MAPT
SCHEMBL11140297 0.80 POLB (0.70) POLBGAAL3MBTL1ALDH1A1MAPT
SCHEMBL2029357 0.80 POLB (0.70) POLBGAAL3MBTL1ALDH1A1HPGD
SCHEMBL6756690 0.80 POLB (1.00) POLBGAAL3MBTL1ALDH1A1LMNA
SCHEMBL31232896 0.80 POLB (1.00) POLBGAAL3MBTL1ALDH1A1LMNA
SCHEMBL11163516 0.79 POLB (0.68) POLBGAAL3MBTL1ALDH1A1ALOX15
SCHEMBL15525257 0.77 POLB (0.66) POLBGAAL3MBTL1ALDH1A1HPGD
SCHEMBL9137234 0.77 TYR (0.43) POLBGAAL3MBTL1ALDH1A1TYR

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-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