SCHEMBL439284

SCHEMBL439284

CC(C)(O)P(=O)(O)CCP(=O)(O)C(C)(C)O.[MgH2]

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
GRM4 Q14833 1/20 0.39
FDPS P14324 8/20 0.35
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33
TYMS P04818 1/20 0.32
CA2 P00918 1/20 0.32
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
TSHR P16473 1/20 0.31
KMT2A Q03164 1/20 0.31
GGPS1 O95749 3/20 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
SCHEMBL440778 0.97 LMNA (0.45) LMNAGRM4FDPSPGK1PGK2
SCHEMBL443426 0.94 LMNA (0.43) LMNAGRM4FDPSPGK1PGK2
SCHEMBL440726 0.94 LMNA (0.43) LMNAGRM4FDPSPGK1PGK2
SCHEMBL444319 0.94 LMNA (0.43) LMNAGRM4FDPSPGK1PGK2
SCHEMBL8951713 0.79 FDPS (0.45) FDPSGGPS1
SCHEMBL6360302 0.78 GABBR2 (0.54) LMNAFDPSMEN1TSHRKMT2A
SCHEMBL8911342 0.77
SCHEMBL8951671 0.76 LMNA (0.33) LMNAGRM4
SCHEMBL8331137 0.70 LMNA (0.38) LMNAGRM4FDPS
SCHEMBL4649888 0.70

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
US-20120064790-A1 Ethylene Diphosphinic Acids CLARIANT FINANCE (BVI) LIMITED (VG) 2012-03-15 US disclosed
US-8084518-B2 Ethylenebis(hydroxyalkylphosphinic acid) and salts thereof CLARIANT FINANCE (BVI) LIMITED (VG) 2011-12-27 US disclosed
US-20100093239-A1 Ethylene Diphosphinic Acids CLARIANT INTERNATIONAL LTD. (CH) 2010-04-15 US disclosed