SCHEMBL2906952

SCHEMBL2906952

[CH2]OP(=O)(COC1(Cn2cnc3cnc(N)nc32)CC1)OCOC(=O)C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.42
POLA1 P09884 1/20 0.42
POLG P54098 1/20 0.42
FAP Q12884 1/20 0.42
SLC22A6 Q4U2R8 1/20 0.42
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
ADRA1A P35348 1/20 0.39
HSD17B10 Q99714 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
HDAC6 Q9UBN7 2/20 0.36
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
BTN3A1 O00481 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
Lb80380 SCHEMBL4270816 0.95 FAP (0.46) ABCB11POLA1POLGFAPSLC22A6
Lb80380 SCHEMBL29355183 0.95 FAP (0.46) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL13178775 0.90 ABCB11 (0.41) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2914228 0.90 ABCB11 (0.42) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2913853 0.89 ABCB11 (0.40) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2914790 0.88 KDM4E (0.39) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2905699 0.88 FAP (0.45) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2912371 0.88 FAP (0.45) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2913623 0.88 FAP (0.49) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2912291 0.87 ABCB11 (0.42) ABCB11POLA1POLGFAPSLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1358198-B1 NOVEL ACYCLIC NUCLEOSIDE PHOSPHONATE DERIVATIVES, SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME LG LIFE SCIENCES LTD (KR) 2010-08-25 EP claimed
US-7157448-B2 Acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same LG LIFE SCIENCES LTD. (KR) 2007-01-02 US claimed
EP-1358198-B1 NOVEL ACYCLIC NUCLEOSIDE PHOSPHONATE DERIVATIVES, SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME LG LIFE SCIENCES LTD (KR) 2010-08-25 EP disclosed