SCHEMBL4585281

SCHEMBL4585281

CCCCCCCCCCCCCCCCCCC(CN)C(O)(O)CCCCCCCCCCCCCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FDPS P14324 11/20 0.46
SMPD1 P17405 2/20 0.40
SPHK1 Q9NYA1 1/20 0.38
LMNA P02545 1/20 0.38
GGPS1 O95749 5/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL30606769 0.88 FDPS (0.52) FDPSLMNAGGPS1
SCHEMBL8061103 0.88 FDPS (0.52) FDPSLMNAGGPS1
SCHEMBL8343147 0.86 FDPS (0.55) FDPSLMNAGGPS1
SCHEMBL8343826 0.86 FDPS (0.55) FDPSLMNAGGPS1
SCHEMBL28906833 0.86 FDPS (0.55) FDPSLMNAGGPS1
SCHEMBL28791845 0.82 FDPS (0.55) FDPSSPHK1LMNAGGPS1
SCHEMBL28945250 0.82 FDPS (0.55) FDPSSPHK1LMNAGGPS1
SCHEMBL28791857 0.82 FDPS (0.55) FDPSSPHK1LMNAGGPS1
SCHEMBL7521059 0.81 FDPS (0.46) FDPSLMNAGGPS1
SCHEMBL28926746 0.79 FDPS (0.52) FDPSSPHK1LMNAGGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1603535-A4 AROMATASE INHIBITOR DIAGNOSIS AND THERAPY ETHICON INC (US) 2008-10-15 EP disclosed
EP-1616182-A4 ENZYME REPLACEMENT THERAPY WITH 17-BETA-HYDROXYSTEROID DEHYDROGENASE-TYPE 2 ETHICON INC (US) 2008-04-16 EP disclosed
EP-1616182-A2 ENZYME REPLACEMENT THERAPY WITH 17-BETA-HYDROXYSTEROID DEHYDROGENASE-TYPE 2 ETHICON, INC. (US) 2006-01-18 EP disclosed
EP-1603535-A2 AROMATASE INHIBITOR DIAGNOSIS AND THERAPY ETHICON, INC. (US) 2005-12-14 EP disclosed
WO-2004082627-A2 ENZYME REPLACEMENT THERAPY WITH 17-β-HYDROXYSTEROID DEHYDROGENASE-TYPE 2 ETHICON, INC. (US) 2004-09-30 WO disclosed
WO-2004082626-A2 AROMATASE INHIBITOR DIAGNOSIS AND THERAPY ETHICON, INC. (US) 2004-09-30 WO disclosed