SCHEMBL16257668

SCHEMBL16257668

COc1ccc(OC[C@H]2O[C@@H](n3ccc(NC(=O)c4ccc(CNC(=O)OCC5c6ccccc6-c6ccccc65)cc4)nc3=O)C[C@H]2O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.46
▸ ABL1 P00519 1/20 0.39
▸ RIN1 Q13671 1/20 0.39
▸ NT5E P21589 2/20 0.39
▸ BMP1 P13497 1/20 0.37
▸ P2RY6 Q15077 2/20 0.37
▸ P2RY14 Q15391 2/20 0.37
▸ DOT1L Q8TEK3 1/20 0.36
▸ HDAC3 O15379 1/20 0.36
▸ HDAC4 P56524 1/20 0.36
▸ HDAC1 Q13547 1/20 0.36
▸ HDAC7 Q8WUI4 1/20 0.36
▸ HDAC2 Q92769 1/20 0.36
▸ HDAC10 Q969S8 1/20 0.36
▸ HDAC11 Q96DB2 1/20 0.36
▸ HDAC8 Q9BY41 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.36
▸ HDAC9 Q9UKV0 1/20 0.36
▸ HDAC5 Q9UQL6 1/20 0.36
▸ TYMS P04818 1/20 0.35

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
SCHEMBL16257629 0.93 POLB (0.41) POLBABL1RIN1NT5EBMP1
SCHEMBL12724973 0.91 POLB (0.44) POLBABL1RIN1NT5EBMP1
SCHEMBL13897163 0.91 POLB (0.44) POLBABL1RIN1NT5EBMP1
SCHEMBL16257667 0.89 POLB (0.56) POLBABL1RIN1NT5EP2RY6
SCHEMBL12724972 0.89 POLB (0.56) POLBABL1RIN1NT5EP2RY6
SCHEMBL13213644 0.85 POLB (0.40) POLBABL1RIN1NT5EBMP1
SCHEMBL16417877 0.83 ADORA1 (0.42) —
SCHEMBL12724971 0.81 POLB (0.46) POLBABL1RIN1NT5EBMP1
SCHEMBL13897166 0.81 POLB (0.46) POLBABL1RIN1NT5EBMP1
SCHEMBL14719079 0.81 POLB (0.60) POLBABL1RIN1NT5EP2RY6

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
US-8889843-B2 Nucleic acid synthesizing dimer amidite and nucleic acid synthesizing method APTA BIOSCIENCES LTD. (GB) 2014-11-18 — — US disclosed
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