SCHEMBL2913797

SCHEMBL2913797

[CH2]OP(=O)(COC1(Cn2cnc3c(NC4CC4)nc(N)nc32)CC1)OCOC(=O)C(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
ABCB11 O95342 1/20 0.41
POLA1 P09884 1/20 0.41
POLG P54098 1/20 0.41
FAP Q12884 1/20 0.41
SLC22A6 Q4U2R8 1/20 0.41
ABCB1 P08183 5/20 0.39
NR1I2 O75469 1/20 0.35
ALB P02768 1/20 0.35
PDE4D Q08499 1/20 0.35
ADORA3 P0DMS8 3/20 0.34
ADORA2A P29274 3/20 0.34
ADORA2B P29275 3/20 0.34
ADORA1 P30542 3/20 0.34
CDK2 P24941 1/20 0.31
CDK9 P50750 1/20 0.31
BCHE P06276 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
SCHEMBL5942534 0.96 POLB (0.47) POLBABCB11POLA1POLGFAP
SCHEMBL2907893 0.89 FAP (0.41) POLBABCB11POLA1POLGFAP
SCHEMBL2905699 0.88 FAP (0.45) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2913623 0.88 FAP (0.49) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2912371 0.88 FAP (0.45) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2910965 0.87 ABCB11 (0.44) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2911382 0.86 FAP (0.46) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2912615 0.86 FAP (0.43) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2911205 0.85 FAP (0.43) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2912516 0.85 FAP (0.43) 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 1 patent. 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 disclosed