SCHEMBL20052008

SCHEMBL20052008

C[C@H](COP(C)OCCC#N)O[C@H](COC(=O)c1ccccc1)n1ccc(=O)[nH]c1=O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ ADRB2 P07550 1/20 0.31
▸ ADRB1 P08588 1/20 0.31
▸ ADRB3 P13945 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ DUT P33316 2/20 0.31
▸ TK1 P04183 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
SCHEMBL14867638 0.94 POLB (0.50) POLBHSD17B10
SCHEMBL13896530 0.85 POLB (0.47) POLBHSD17B10
SCHEMBL20052002 0.81 POLB (0.32) POLBHSD17B10ADRB2ADRB1ADRB3
SCHEMBL13443476 0.81 POLB (0.52) POLBHSD17B10DUT
SCHEMBL20052005 0.80 POLB (0.72) POLBHSD17B10ADRB2ADRB1ADRB3
SCHEMBL17445607 0.78 POLB (0.47) POLBHSD17B10
SCHEMBL14867649 0.76 POLB (0.31) POLBHSD17B10
SCHEMBL19221808 0.76 POLB (0.46) POLBHSD17B10
SCHEMBL19221888 0.76 POLB (0.46) POLBHSD17B10
SCHEMBL20052007 0.76 KDM4E (0.36) —

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-9944929-B2 UNA single stranded oligomers for therapeutics ARCTURUS THERAPEUTICS, INC. (US) 2018-04-17 — — US disclosed
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