SCHEMBL8337169

SCHEMBL8337169

NC(CP(=O)(O)O)(CP(=O)(O)O)P(=O)(O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 8/20 0.41
GRM4 Q14833 1/20 0.39
KDM4E B2RXH2 1/20 0.35
MMP2 P08253 1/20 0.35
THRB P10828 1/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ALDH1A1 P00352 1/20 0.35
PDE3A Q14432 2/20 0.35
LMNA P02545 2/20 0.35
ADRB3 P13945 1/20 0.35
PDE4D Q08499 1/20 0.35
SMPD1 P17405 2/20 0.33
CYP3A4 P08684 1/20 0.32
NFKB1 P19838 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
ANPEP P15144 1/20 0.32
ERAP2 Q6P179 1/20 0.32
OTC P00480 1/20 0.32

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
SCHEMBL10976071 0.83 GRM4 (0.52) FDPSGRM4ALDH1A1PDE3ALMNA
SCHEMBL11746955 0.79 FDPS (0.43) FDPSGRM4KDM4EMMP2THRB
SCHEMBL11474902 0.75 GRM4 (0.42) FDPSGRM4KDM4EMMP2THRB
SCHEMBL2510162 0.75
SCHEMBL1757439 0.75 GRM4 (0.42) FDPSGRM4KDM4EMMP2THRB
SCHEMBL3170882 0.71 FDPS (0.50) FDPSGRM4PDE3ALMNAADRB3
SCHEMBL970448 0.71
SCHEMBL10784249 0.69 KDM4E (0.39) FDPSGRM4KDM4EMMP2THRB
SCHEMBL249600 0.69 KDM4E (0.39) FDPSGRM4KDM4EMMP2THRB
Hydrochloric Acid SCHEMBL9329345 0.69 FDPS (0.48) FDPSGRM4PDE3ALMNAADRB3

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
EP-0802919-A4 RAPIDLY CLEARING TECHNETIUM-99m PHOSPHONATE SKELETAL IMAGING AGENTS MALLINCKRODT MEDICAL INC (US) 1999-08-18 EP disclosed
EP-0802919-A1 RAPIDLY CLEARING TECHNETIUM-99m PHOSPHONATE SKELETAL IMAGING AGENTS MALLINCKRODT MEDICAL, INC. (US) 1997-10-29 EP disclosed
WO-1995033757-A1 RAPIDLY CLEARING TECHNETIUM-99m PHOSPHONATE SKELETAL IMAGING AGENTS MALLINCKRODT MEDICAL, INC. (US) 1995-12-14 WO disclosed
EP-0006659-B1 COMPOSITIONS USEFUL IN THE PREPARATION OF STABILIZED RADIOGRAPHIC SCANNING AGENTS, A METHOD OF PREPARING THEM AND THE USE OF STANNOUS GENTISILATE AS STABILIZER IN THESE COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1982-04-21 EP disclosed
US-4234562-A WITH TECHNETIUM-99, A STANNOUS, FERROUS OR CHROMOUS CHLORIDE OR SULFATE, AN ORGANIC PHOSPHONIC ACID THE PROCTER & GAMBLE COMPANY (US) 1980-11-18 US disclosed