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Sugi Predict / Compounds / SCHEMBL20324868

SCHEMBL20324868

SCHEMBL20324868

Nc1nc2c(ncn2[C@H]2CCC(COP(=O)(O)O[C@H]3C[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)(O)O)O2)c(=O)[nH]1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 1/20 0.53
▸ POLB P06746 1/20 0.52
▸ FUT5 Q11128 1/20 0.49
▸ RNASEL Q05823 2/20 0.49
▸ P2RY2 P41231 1/20 0.48
▸ P2RY4 P51582 1/20 0.48
▸ P2RY6 Q15077 1/20 0.48

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
SCHEMBL21540009 1.00 TERT (0.53) TERTPOLBFUT5RNASELP2RY2
SCHEMBL20782764 1.00 TERT (0.53) TERTPOLBFUT5RNASELP2RY2
SCHEMBL20325223 1.00 TERT (0.53) TERTPOLBFUT5RNASELP2RY2
SCHEMBL18822882 0.95 TERT (0.52) TERTPOLBFUT5P2RY2P2RY4
SCHEMBL26570660 0.95 TERT (0.52) TERTPOLBFUT5RNASELP2RY2
SCHEMBL20782763 0.94 POLB (0.58) TERTPOLBFUT5P2RY2P2RY4
SCHEMBL22765983 0.94 TERT (0.48) TERTPOLBFUT5RNASELP2RY2
SCHEMBL22765945 0.94 TERT (0.48) TERTPOLBFUT5RNASELP2RY2
SCHEMBL25512666 0.93 TERT (0.54) TERTPOLBFUT5P2RY2P2RY4
SCHEMBL20327069 0.92 RNASEL (0.48) POLBRNASEL

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-2018118664-A1 COMBINATIONS OF PD-1 ANTAGONISTS AND CYCLIC DINUCLEOTIDE STING AGONISTS FOR CANCER TREATMENT MERCK SHARP & DOHME CORP. (US) 2018-06-28 — — WO disclosed
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