SCHEMBL21454925

SCHEMBL21454925

Nc1nc2c(ncn2C2OC(C(O)CO)C[C@@H]2OP(=O)(O)OC[C@@H]2CCC(n3cnc4c(N)ncnc43)O2)c(=O)[nH]1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FUT5 Q11128 1/20 0.47
▸ TERT O14746 1/20 0.44
▸ STING1 Q86WV6 10/20 0.44
▸ DTYMK P23919 2/20 0.44
▸ POLB P06746 1/20 0.43
▸ TGM2 P21980 1/20 0.42

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
SCHEMBL21454874 0.91 FUT5 (0.50) FUT5TERTSTING1DTYMKTGM2
SCHEMBL21454900 0.91 FUT5 (0.50) FUT5TERTSTING1DTYMKTGM2
SCHEMBL21454721 0.90 FUT5 (0.48) FUT5STING1DTYMKTGM2
SCHEMBL21454902 0.90 RNASEL (0.45) —
SCHEMBL20325223 0.84 TERT (0.53) FUT5TERTPOLB
SCHEMBL20782764 0.84 TERT (0.53) FUT5TERTPOLB
SCHEMBL20324868 0.84 TERT (0.53) FUT5TERTPOLB
SCHEMBL21540009 0.84 TERT (0.53) FUT5TERTPOLB
SCHEMBL18822882 0.84 TERT (0.52) FUT5TERTDTYMKPOLB
SCHEMBL20324601 0.83 FUT5 (0.45) FUT5STING1TGM2

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-2019193542-A1 2'3'-CYCLIC DINUCLEOTIDES INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR, V.V.I. (CZ) 2019-10-10 — — WO disclosed
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