SCHEMBL16217855

SCHEMBL16217855

Cc1cn(C2C[C@@H](OP(=O)(S)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)C[C@H]3OP(=O)(S)OC[C@@H]3CCC(n4cnc5c(=O)[nH]c(N)nc54)O3)[C@@H](COP(=O)(O)S)O2)c(=O)nc1N

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 1/20 0.50
▸ POLB P06746 2/20 0.46
▸ DTYMK P23919 4/20 0.46
▸ F2 P00734 2/20 0.46
▸ FUT5 Q11128 1/20 0.41
▸ P2RY2 P41231 1/20 0.41
▸ P2RY4 P51582 1/20 0.41
▸ P2RY6 Q15077 1/20 0.41
▸ P2RY1 P47900 1/20 0.41

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
SCHEMBL16221824 0.96 POLB (0.50) TERTPOLBF2FUT5P2RY2
SCHEMBL18158912 0.96 POLB (0.50) TERTPOLBF2FUT5P2RY2
SCHEMBL22434567 0.94 POLB (0.51) TERTPOLBDTYMKF2P2RY2
SCHEMBL20326935 0.94 POLB (0.51) TERTPOLBDTYMKF2P2RY2
SCHEMBL16221597 0.94 POLB (0.51) TERTPOLBDTYMKF2P2RY2
SCHEMBL16410980 0.94 POLB (0.47) POLBDTYMKP2RY1
SCHEMBL24239526 0.93 TERT (0.57) TERTPOLBDTYMKF2P2RY2
SCHEMBL16221825 0.89 POLB (0.56) POLBF2FUT5P2RY2P2RY4
SCHEMBL18158882 0.88 DTYMK (0.58) TERTPOLBDTYMKF2
SCHEMBL24239532 0.88 DTYMK (0.58) TERTPOLBDTYMKF2

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
WO-2014179626-A2 COMPOSITIONS AND METHODS FOR MODULATING APOLIPOPROTEIN C-III EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2014-11-06 — — WO disclosed
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