SCHEMBL7032708

SCHEMBL7032708

O=C(O)CCCCC(P(=O)(O)O)P(O)(O)=S.[Na].[Na]

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 6/20 0.44
FDPS P14324 5/20 0.42
GGPS1 O95749 1/20 0.42
LMNA P02545 2/20 0.41
GSTK1 Q9Y2Q3 2/20 0.40
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
PMP22 Q01453 1/20 0.39
ENPEP Q07075 1/20 0.39
NAALAD2 Q9Y3Q0 1/20 0.39
FFAR4 Q5NUL3 1/20 0.38

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
SCHEMBL5011486 0.86 FDPS (0.56) FOLH1FDPSGGPS1LMNAGSTK1
SCHEMBL328880 0.84 FDPS (0.57) FOLH1FDPSGGPS1LMNAGSTK1
SCHEMBL21611867 0.80 FOLH1 (0.59) FOLH1FDPSGGPS1LMNATSHR
SCHEMBL7030259 0.76 FDPS (0.45) FDPS
SCHEMBL11396532 0.71 FOLH1 (0.73) FOLH1LMNAGSTK1TSHRNFKB1
SCHEMBL1850194 0.71 FOLH1 (0.60) FOLH1FDPSLMNATSHRNAALAD2
Adipic Acid SCHEMBL4637028 0.70 LMNA (0.73) FOLH1LMNATSHRNFKB1PMP22
SCHEMBL20699855 0.70 FDPS (0.75) FDPS
Phosphoric Acid SCHEMBL28968052 0.68 KDM4C (0.53) FOLH1LMNAGSTK1TSHRNFKB1
SCHEMBL10863085 0.67 FDPS (0.76) FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1131327-B1 PROSTAGLANDIN CONJUGATES FOR TREATING OR PREVENTING BONE DISEASES MERCK FROSST CANADA INC (CA) 2003-02-19 EP disclosed
EP-1131327-A1 PROSTAGLANDIN CONJUGATES FOR TREATING OR PREVENTING BONE DISEASE Merck Frosst Canada & Co. (CA) 2001-09-12 EP disclosed
US-6121253-A BONE GROWTH-ENHANCING PROSTAGLANDIN DERIVATIVE CONTAINING BISPHOSPHONATE GROUPS TO INHIBIT BONE RESORPTION; DRUG DELIVERY, SIDE EFFECT REDUCTION, OSTEOPOROSIS MERCK FROSST CANADA & CO. (CA) 2000-09-19 US disclosed
WO-2000031084-A1 PROSTAGLANDIN CONJUGATES FOR TREATING OR PREVENTING BONE DISEASE MERCK FROSST CANADA & CO. (CA) 2000-06-02 WO disclosed