SCHEMBL2299087

SCHEMBL2299087

O=COC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.[NaH]

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TDP1 Q9NUW8 1/20 0.46
PDE4A P27815 1/20 0.40
USP2 O75604 1/20 0.38
SLCO1B1 Q9Y6L6 1/20 0.38
KDM4E B2RXH2 2/20 0.35
AKR1B1 P15121 1/20 0.32
MGAM O43451 1/20 0.31
TOP1 P11387 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
SCHEMBL13564709 0.98 LMNA (0.50) LMNAL3MBTL1TDP1PDE4AUSP2
SCHEMBL21419878 0.98 LMNA (0.50) LMNAL3MBTL1TDP1PDE4AUSP2
SCHEMBL10537769 0.98 LMNA (0.50) LMNAL3MBTL1TDP1PDE4AUSP2
SCHEMBL13564642 0.98 LMNA (0.50) LMNAL3MBTL1TDP1PDE4AUSP2
SCHEMBL13564638 0.93 LMNA (0.43) LMNAL3MBTL1TDP1PDE4AUSP2
SCHEMBL2161822 0.84 AKR1B1 (0.36) LMNAL3MBTL1TDP1PDE4AAKR1B1
SCHEMBL7183891 0.84 AKR1B1 (0.36) LMNAL3MBTL1TDP1PDE4AAKR1B1
Demannose SCHEMBL10423686 0.80 LMNA (0.33) LMNAL3MBTL1TDP1PDE4A
SCHEMBL10489052 0.78 MPI (0.39)
SCHEMBL28075212 0.76 LMNA (0.50) LMNAL3MBTL1TDP1PDE4AUSP2

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
US-8808718-B2 Hypertonic organic acid or salt thereof disinfectant composition and its use in dental treatment NIKINC PHARMA B.V. (NL) 2014-08-19 US disclosed
US-20120328708-A1 DISINFECTANT COMPOSITION AND ITS USE IN DENTAL TREATMENT NIKINC PHARMA B.V. (NL) 2012-12-27 US disclosed
EP-2536378-A2 DISINFECTANT COMPOSITION AND ITS USE IN DENTAL TREATMENT Nikinc Pharma B.V. (NL) 2012-12-26 EP disclosed
WO-2011102724-A2 DISINFECTANT COMPOSITION AND ITS USE IN DENTAL TREATMENT UNIVERSITEIT VAN AMSTERDAM (NL) 2011-08-25 WO disclosed