SCHEMBL3049013

SCHEMBL3049013

[CH2]CC(O)(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 8/20 0.48
FDPS P14324 18/20 0.48
PDE3A Q14432 2/20 0.48
LMNA P02545 2/20 0.48
ADRB3 P13945 1/20 0.48
PDE4D Q08499 1/20 0.48

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
SCHEMBL24616673 0.73 FDPS (0.68) GGPS1FDPSPDE3ALMNAADRB3
SCHEMBL24616672 0.73 FDPS (0.52) GGPS1FDPSPDE3ALMNAADRB3
SCHEMBL2702334 0.71 FDPS (0.50) GGPS1FDPSPDE3ALMNAADRB3
SCHEMBL7762827 0.71 FDPS (0.61) GGPS1FDPSPDE3ALMNAADRB3
SCHEMBL4906431 0.69 FDPS (0.42) GGPS1FDPSPDE3ALMNAADRB3
SCHEMBL11498890 0.69 FDPS (0.42) GGPS1FDPSPDE3ALMNAADRB3
SCHEMBL15411105 0.69 FDPS (0.48) GGPS1FDPSPDE3ALMNAADRB3
SCHEMBL6667332 0.69 FDPS (0.48) GGPS1FDPSPDE3ALMNAADRB3
SCHEMBL3144201 0.69 FDPS (0.48) GGPS1FDPSPDE3ALMNAADRB3
SCHEMBL2152289 0.69 FDPS (0.48) GGPS1FDPSPDE3ALMNAADRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010116132-A2 BISPHOSPHONATE COMPOUNDS FOR CHELATING RADIONUCLIDES KING'S COLLEGE LONDON (GB) 2010-10-14 WO disclosed