SCHEMBL9254732

SCHEMBL9254732

CC(O)COC(C(C)C)(C(C)C)P(=O)(O)O

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.46
FDPS P14324 1/20 0.32
PGK1 P00558 1/20 0.32
PGK2 P07205 1/20 0.32
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL8752218 0.80 MAPK1 (0.34) MAPK1FDPS
SCHEMBL6226264 0.73 ALDH1A1 (0.33) FDPS
SCHEMBL6004458 0.71
SCHEMBL7159089 0.67 MAPK1 (0.40) MAPK1PGK1PGK2HSD17B10
Phosphoric Acid SCHEMBL4624441 0.67 HSD17B10 (0.50) MAPK1PGK1PGK2HSD17B10
SCHEMBL10448202 0.67 MAPK1 (0.42) MAPK1
SCHEMBL28911607 0.66 MAPK1 (0.41) MAPK1
SCHEMBL3344507 0.66
SCHEMBL1079057 0.66
SCHEMBL3340733 0.66

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
EP-0452935-B1 Chiral 2-(phosphonomethoxy)propyl guanines as antiviral agents ACAD OF SCIENCE CZECH REPUBLIC (CS) 1995-06-21 EP disclosed
EP-0452935-A1 Chiral 2-(phosphonomethoxy)propyl guanines as antiviral agents INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CS) 1991-10-23 EP disclosed