SCHEMBL8086314

SCHEMBL8086314

O=P(O)(O)C(I)P(=O)(O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
MMP2 P08253 1/20 0.38
THRB P10828 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
FDPS P14324 5/20 0.35
LAP3 P28838 2/20 0.33
ANPEP P15144 1/20 0.33
ERAP2 Q6P179 1/20 0.33
TYMS P04818 1/20 0.33
CA2 P00918 1/20 0.33
SLC34A1 Q06495 1/20 0.31
PGK1 P00558 2/20 0.30
PGK2 P07205 2/20 0.30
GABBR2 O75899 1/20 0.30
GABBR1 Q9UBS5 1/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL9683090 0.78
SCHEMBL11095218 0.75
Phosphoric Acid SCHEMBL23501797 0.67
SCHEMBL1409859 0.64 KDM4E (0.43) KDM4EMMP2THRBMAPK1HSD17B10
SCHEMBL919194 0.64
SCHEMBL4105786 0.64 KDM4E (0.43) KDM4EMMP2THRBMAPK1HSD17B10
SCHEMBL699017 0.64
SCHEMBL3192524 0.61
SCHEMBL9793676 0.61
Oxidronic Acid SCHEMBL393281 0.61 KDM4E (0.40) KDM4EMMP2THRBMAPK1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5442084-A Method of selective fluorination AIR PRODUCTS AND CHEMICALS, INC. (US) 1995-08-15 US claimed
EP-1038864-A1 NOVEL METALLOPROTEINASE INHIBITORS FUJI YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 2000-09-27 EP disclosed
EP-0479813-B1 NOVEL METHYLENEBISPHOSPHONIC ACID DERIVATIVES LEIRAS OY (FI) 1995-09-20 EP disclosed
US-5442084-A Method of selective fluorination AIR PRODUCTS AND CHEMICALS, INC. (US) 1995-08-15 US disclosed
US-5376649-A For bone disorders LEIRAS OY (FI) 1994-12-27 US disclosed
EP-0479813-A1 NOVEL METHYLENEBISPHOSPHONIC ACID DERIVATIVES. HUHTAMAEKI YHTHYMAE OY (FI) 1992-04-15 EP disclosed
WO-1990015806-A1 NOVEL METHYLENEBISPHOSPHONIC ACID DERIVATIVES Huhtamäki Oy (FI) 1990-12-27 WO disclosed
US-4689123-A Novel tetraphosphonic acid compounds, intermediates and a process for their production THE DOW CHEMICAL COMPANY (US) 1987-08-25 US disclosed