SCHEMBL4963595

SCHEMBL4963595

CC(C)OP(=O)(CO[C]1CC1)OC(C)C

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSA P10619 1/20 0.34
ACHE P22303 1/20 0.34
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL4963603 0.67 CTSA (0.34) CTSAACHEALDH1A1KDM4EPOLB
SCHEMBL14260070 0.67 CTSA (0.34) CTSAACHEALDH1A1KDM4EPOLB
SCHEMBL114969 0.66 CTSA (0.48) CTSAACHEALDH1A1KDM4EPOLB
SCHEMBL525985 0.66 CTSA (0.48) CTSAACHEALDH1A1KDM4EPOLB
SCHEMBL8759510 0.66 ALDH1A3 (0.51) ALDH1A1KDM4EL3MBTL1
SCHEMBL2912398 0.65 CTSA (0.33) CTSAACHEALDH1A1KDM4EPOLB
SCHEMBL1034114 0.65 CTSA (0.37) CTSAACHEALDH1A1KDM4EPOLB
SCHEMBL1003565 0.64 TSHR (0.46) CTSAACHEALDH1A1KDM4EPOLB
SCHEMBL8626497 0.64 CTSA (0.46) CTSAACHEALDH1A1KDM4EPOLB
SCHEMBL2912394 0.64 KDM4E (0.32) CTSAACHEALDH1A1KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1358198-A4 NOVEL ACYCLIC NUCLEOSIDE PHOSPHONATE DERIVATIVES, SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME LG LIFE SCIENCES LTD (KR) 2008-03-05 EP disclosed
EP-1715873-A1 NUCLEOSIDE PHOSPHONATE DERIVATIVES USEFUL IN THE TREATMENT OF HIV INFECTIONS LG Life Sciences Ltd. (KR) 2006-11-02 EP disclosed
WO-2005079812-A1 NUCLEOSIDE PHOSPHONATE DERIVATIVES USEFUL IN THE TREATMENT OF HIV INFECTIONS LG LIFE SCIENCES LTD. (KR) 2005-09-01 WO disclosed
EP-1358198-A1 NOVEL ACYCLIC NUCLEOSIDE PHOSPHONATE DERIVATIVES, SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME LG Chem Investment, Ltd. (KR) 2003-11-05 EP disclosed
WO-2002057288-A1 NOVEL ACYCLIC NUCLEOSIDE PHOSPHONATE DERIVATIVES, SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME LG LIFE SCIENCES LTD. (KR) 2002-07-25 WO disclosed