SCHEMBL17528508

SCHEMBL17528508

Nc1ncnc2c1ncn2C1=CC(CO)[C@H](O)[C@@H]1O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHCYL1 O43865 3/20 0.65
AHCY P23526 11/20 0.50
ADORA2B P29275 2/20 0.47
PI4KA P42356 2/20 0.47
PI4K2B Q8TCG2 2/20 0.47
PI4K2A Q9BTU6 2/20 0.47
PI4KB Q9UBF8 2/20 0.47
ADORA3 P0DMS8 2/20 0.47
DPP4 P27487 1/20 0.47
MEN1 O00255 1/20 0.47
SLC28A1 O00337 1/20 0.47
MAP3K7 O43318 1/20 0.47
SLC28A2 O43868 1/20 0.47
GAPDH P04406 1/20 0.47
MAPK1 P28482 1/20 0.47
ADORA2A P29274 1/20 0.47
ADORA1 P30542 1/20 0.47
STAT6 P42226 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL17501761 1.00 AHCYL1 (0.65) AHCYL1AHCYADORA2BPI4KAPI4K2B
SCHEMBL17501744 1.00 AHCYL1 (0.65) AHCYL1AHCYADORA2BPI4KAPI4K2B
SCHEMBL29361147 1.00 AHCYL1 (0.65) AHCYL1AHCYADORA2BPI4KAPI4K2B
SCHEMBL17532522 0.79 AHCYL1 (1.00) AHCYL1AHCYSMN1; SMN2
SCHEMBL17532524 0.79 AHCYL1 (1.00) AHCYL1AHCYSMN1; SMN2
SCHEMBL17532526 0.77 AHCYL1 (1.00) AHCYL1AHCY
SCHEMBL17532523 0.77 AHCYL1 (1.00) AHCYL1AHCY
SCHEMBL17501730 0.75 PI4KA (0.53) AHCYADORA2BPI4KAPI4K2BPI4K2A
SCHEMBL21084885 0.75 PI4KA (0.53) AHCYADORA2BPI4KAPI4K2BPI4K2A
SCHEMBL17501766 0.75 PI4KA (0.53) AHCYADORA2BPI4KAPI4K2BPI4K2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10787478-B2 Enantiomers of the 1′,6′-isomer of neplanocin A AUBURN UNIVERSITY (US) 2020-09-29 US disclosed
US-20190202854-A1 ENANTIOMERS OF THE 1',6'-ISOMER OF NEPLANOCIN A AUBURN UNIVERSITY 2019-07-04 US disclosed
US-10227373-B2 Enantiomers of the 1′,6′-isomer of neplanocin A AUBURN UNIVERSITY (US) 2019-03-12 US disclosed
US-20170260223-A1 ENANTIOMERS OF THE 1',6'-ISOMER OF NEPLANOCIN A AUBURN UNIVERSITY 2017-09-14 US disclosed
US-20170260223-A1 ENANTIOMERS OF THE 1',6'-ISOMER OF NEPLANOCIN A AUBURN UNIVERSITY 2017-09-14 US disclosed
US-9657048-B2 Enantiomers of the 1′,6′-isomer of neplanocin A AUBURN UNIVERSITY (US) 2017-05-23 US disclosed
US-9657048-B2 Enantiomers of the 1′,6′-isomer of neplanocin A AUBURN UNIVERSITY (US) 2017-05-23 US disclosed
WO-2016022563-A1 ENANTIOMERS OF THE 1',6'-ISOMER OF NEPLANOCIN A AUBURN UNIVERSITY (US) 2016-02-11 WO disclosed
US-20160039860-A1 ENANTIOMERS OF THE 1',6'-ISOMER OF NEPLANOCIN A AUBURN UNIVERSITY 2016-02-11 US disclosed
US-20160039860-A1 ENANTIOMERS OF THE 1',6'-ISOMER OF NEPLANOCIN A AUBURN UNIVERSITY 2016-02-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10787478-B2 Enantiomers of the 1′,6′-isomer of neplanocin A NME2, NTPCR, SAMHD1 AHCYL1 35/4885AHCY 32/4885ADORA2B 1600/4885
US-10227373-B2 Enantiomers of the 1′,6′-isomer of neplanocin A NME2, NTPCR, SAMHD1 AHCYL1 35/4885AHCY 32/4885ADORA2B 1600/4885
US-20170260223-A1 ENANTIOMERS OF THE 1',6'-ISOMER OF NEPLANOCIN A NME2, NTPCR, SAMHD1 AHCYL1 35/4885AHCY 32/4885ADORA2B 1574/4885
US-20160039860-A1 ENANTIOMERS OF THE 1',6'-ISOMER OF NEPLANOCIN A NME2, NTPCR, SAMHD1 AHCYL1 35/4885AHCY 32/4885ADORA2B 1574/4885
US-20190202854-A1 ENANTIOMERS OF THE 1',6'-ISOMER OF NEPLANOCIN A NME2, NTPCR, SAMHD1 AHCYL1 35/4885AHCY 32/4885ADORA2B 1574/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.