SCHEMBL4081026

SCHEMBL4081026

Nc1nc2c(ncn2[C@@H]2O[C@H](C(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)[nH]1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NT5E P21589 1/20 0.60
TGM2 P21980 1/20 0.56
IMPDH2 P12268 6/20 0.54
HINT1 P49773 1/20 0.53
STING1 Q86WV6 2/20 0.52
PDE3B Q13370 1/20 0.52
PDE3A Q14432 1/20 0.52
TAAR1 Q96RJ0 1/20 0.51
KRAS P01116 4/20 0.51
IMPDH1 P20839 2/20 0.50
GSK3A P49840 2/20 0.50
RPS6KA3 P51812 2/20 0.50
MAPK14 Q16539 2/20 0.50
FUT5 Q11128 1/20 0.50

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
SCHEMBL5861503 1.00 NT5E (0.60) NT5ETGM2IMPDH2HINT1STING1
Guanosine SCHEMBL2447866 0.93 NT5E (0.62) NT5ETGM2IMPDH2HINT1KRAS
SCHEMBL9124928 0.92 NT5E (0.53) NT5ETGM2IMPDH2HINT1STING1
SCHEMBL407394 0.90 NT5E (0.59) NT5ETGM2IMPDH2HINT1STING1
SCHEMBL1527362 0.90 NT5E (0.59) NT5ETGM2IMPDH2HINT1STING1
SCHEMBL19183426 0.88 NT5E (0.57) NT5ETGM2IMPDH2HINT1STING1
SCHEMBL22636005 0.87 NT5E (0.62) NT5ETGM2IMPDH2HINT1STING1
SCHEMBL22498538 0.87 NT5E (0.62) NT5ETGM2IMPDH2HINT1STING1
SCHEMBL4651242 0.87 NT5E (0.56) NT5ETGM2IMPDH2HINT1STING1
SCHEMBL30867115 0.87 NT5E (0.53) NT5ETGM2IMPDH2HINT1STING1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7575901-B2 Propagating escherichia mutant which produces 5'-inosinic acid or 5'-guanylic acid; identifying nucleotidase gene associated with generating nucleoside 5'-phosphate esters AJINOMOTO CO., INC. (JP) 2009-08-18 US claimed
US-20080026428-A1 METHOD FOR PRODUCING NUCLEOTIDE BY FERMENTATION AJINOMOTO CO., INC. (JP) 2008-01-31 US claimed
WO-2022266027-A1 PREVENTION AND TREATMENT OF POST-INFECTION NEUROLOGICAL DISORDERS AND CLOTTING/THROMBOTIC DISORDERS BARANOWITZ STEVEN (US) 2022-12-22 WO disclosed
EP-3641566-A1 METHODS FOR INCREASING GROWTH OF BENEFICIAL BACTERIA IN THE GASTROINTESTINAL TRACT Abbott Laboratories (US) 2020-04-29 EP disclosed
WO-2018237149-A1 METHODS FOR INCREASING GROWTH OF BENEFICIAL BACTERIA IN THE GASTROINTESTINAL TRACT ABBOTT LABORATORIES (US) 2018-12-27 WO disclosed
US-20120184503-A1 NUTRITIONAL COMPOSITIONS COMPRISING HUMAN MILK OLIGOSACCHARIDES AND NUCLEOTIDES AND USES THEREOF FOR TREATING AND/OR PREVENTING ENTERIC VIRAL INFECTION ABBOTT LABORATORIES (US) 2012-07-19 US disclosed