SCHEMBL3904202

SCHEMBL3904202

O=P(O)(O)C(CO)P(=O)(O)O.O=P(O)(O)C(CO)P(=O)(O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 8/20 0.48
KDM4E B2RXH2 1/20 0.41
MMP2 P08253 1/20 0.41
THRB P10828 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TYMS P04818 1/20 0.37
ANPEP P15144 1/20 0.36
ERAP2 Q6P179 1/20 0.36
LAP3 P28838 1/20 0.35
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
BLM P54132 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL56898 1.00 FDPS (0.48) FDPSKDM4EMMP2THRBMAPK1
Water SCHEMBL30541817 0.97 FDPS (0.46) FDPSKDM4EMMP2THRBMAPK1
SCHEMBL30607730 0.97 FDPS (0.46) FDPSKDM4EMMP2THRBMAPK1
SCHEMBL28378469 0.97 FDPS (0.46) FDPSKDM4EMMP2THRBMAPK1
Ammonia Solution, Strong SCHEMBL1478027 0.97 FDPS (0.46) FDPSKDM4EMMP2THRBMAPK1
SCHEMBL1877265 0.97 FDPS (0.46) FDPSKDM4EMMP2THRBMAPK1
SCHEMBL31304816 0.97 FDPS (0.46) FDPSKDM4EMMP2THRBMAPK1
SCHEMBL10619694 0.97 FDPS (0.46) FDPSKDM4EMMP2THRBMAPK1
SCHEMBL32670822 0.97 FDPS (0.46) FDPSKDM4EMMP2THRBMAPK1
SCHEMBL31122734 0.97 FDPS (0.46) FDPSKDM4EMMP2THRBMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539345-A4 CALCIUM HYDROXIDE ABSORBENT WITH RHEOLOGY MODIFIER AND PROCESS INVOLVING SAME GRACE W R & CO (US) 2009-01-28 EP claimed
EP-1539345-A2 CALCIUM HYDROXIDE ABSORBENT WITH RHEOLOGY MODIFIER AND PROCESS INVOLVING SAME W.R. Grace & Co. (US) 2005-06-15 EP claimed
WO-2004022641-A2 CALCIUM HYDROXIDE ABSORBENT WITH RHEOLOGY MODIFIER AND PROCESS INVOLVING SAME W.R. GRACE & CO.-CONN (US) 2004-03-18 WO claimed