SCHEMBL6681748

SCHEMBL6681748

CC(C)OP(=O)(O)P(=O)(O)OC(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSA P10619 1/20 0.50
ACHE P22303 1/20 0.50
KDM4E B2RXH2 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
ALDH1A1 P00352 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
POLB P06746 1/20 0.36
CA2 P00918 2/20 0.35
LAP3 P28838 1/20 0.35
PTPN5 P54829 1/20 0.34
GAA P10253 1/20 0.32
ATM Q13315 1/20 0.32
METAP1 P53582 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL3071467 0.88 CTSA (0.46) CTSAACHEKDM4ETDP1ALDH1A1
SCHEMBL13347785 0.87 TDP1 (0.43) CTSAACHEKDM4ETDP1ALDH1A1
Phosphorylisopropane SCHEMBL82996 0.80
SCHEMBL268599 0.80 CTSA (0.50) CTSAACHEKDM4ETDP1ALDH1A1
Phosphorylisopropane SCHEMBL17670024 0.78
SCHEMBL587875 0.78
Phosphorylisopropane SCHEMBL11420590 0.78 CTSA (0.48) CTSAACHEKDM4ETDP1ALDH1A1
Phosphorylisopropane SCHEMBL10821980 0.78
Phosphorylisopropane SCHEMBL17670026 0.78 CTSA (0.48) CTSAACHEKDM4ETDP1ALDH1A1
SCHEMBL9268971 0.78

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-1472319-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2004-11-03 EP disclosed
WO-2004065305-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE UNIVERSITY OF DAYTON (US) 2004-08-05 WO disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed