SCHEMBL2908701

SCHEMBL2908701

[CH2]OP(=O)(COC1(Cn2cnc3c(N4CCOCC4)nc(N)nc32)CC1)OCOC(=O)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
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
HDAC1 Q13547 9/20 0.40
HDAC2 Q92769 2/20 0.40
PIK3CA P42336 7/20 0.35
MTOR P42345 5/20 0.35
PIK3R1 P27986 5/20 0.35
PIK3CD O00329 3/20 0.35
PIK3CB P42338 3/20 0.35
PIK3CG P48736 3/20 0.35
TLR9 Q9NR96 2/20 0.34
TLR7 Q9NYK1 2/20 0.34
HRH4 Q9H3N8 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33

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
SCHEMBL4267837 0.96 ABCB11 (0.44) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2942127 0.89 ABCB11 (0.41) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL13328467 0.89 FAP (0.46) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL13328463 0.88 FAP (0.46) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2912371 0.88 FAP (0.45) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2905699 0.88 FAP (0.45) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2913623 0.88 FAP (0.49) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL13328465 0.87 FAP (0.47) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2910965 0.87 ABCB11 (0.44) ABCB11POLA1POLGFAPSLC22A6
SCHEMBL2911382 0.86 FAP (0.46) 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 2 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
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