SCHEMBL2773023

SCHEMBL2773023

O=C(O)[C@@](O)([Ti])[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.43
LMNA P02545 2/20 0.41
USP2 O75604 1/20 0.41
SLCO1B1 Q9Y6L6 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
OR51E2 Q9H255 1/20 0.31
KDM4E B2RXH2 2/20 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
SCHEMBL9763747 0.83 USP2 (0.48) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL18825609 0.83 USP2 (0.48) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL29159266 0.83 USP2 (0.48) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL6817366 0.79 PDE4A (0.43) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL29879125 0.79 PDE4A (0.43) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL8465616 0.78 PDE4A (0.46) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL7025484 0.77 USP2 (0.47) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL28449969 0.77 USP2 (0.47) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL8356023 0.77 USP2 (0.47) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL2933991 0.75 PDE4A (0.43) PDE4ALMNAUSP2SLCO1B1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1490580-B1 HIGH TEMPERATURE SEAWATER-BASED CROSS-LINKED FRACTURING FLUIDS AND METHODS HALLIBURTON ENERGY SERV INC (US) 2010-04-28 EP claimed