SCHEMBL21136341

SCHEMBL21136341

C#C[C@@]1(F)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N(C3CC3)C3CC3)nc(N)nc21

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 5/20 0.44
ADORA3 P0DMS8 6/20 0.39
ADORA1 P30542 5/20 0.39
ADORA2B P29275 3/20 0.39
ADA P00813 1/20 0.39
ALOX15 P16050 1/20 0.39
CYP2C19 P33261 1/20 0.39
SLC29A1 Q99808 3/20 0.38
PGK1 P00558 1/20 0.37
PGK2 P07205 1/20 0.37
LMNA P02545 1/20 0.36
NT5E P21589 1/20 0.36
HIF1A Q16665 1/20 0.36

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
SCHEMBL18061773 0.91 ADORA2A (0.44) ADORA2AADORA3ADORA1ADORA2BADA
SCHEMBL18061807 0.91 ADORA2A (0.44) ADORA2AADORA3ADORA1ADORA2BADA
SCHEMBL18061805 0.88 ADORA2A (0.46) ADORA2AADORA3ADORA1ADORA2BADA
SCHEMBL21137196 0.88 ADORA2A (0.46) ADORA2AADORA3ADORA1ADORA2BADA
SCHEMBL18061771 0.88 ADORA2A (0.46) ADORA2AADORA3ADORA1ADORA2BADA
SCHEMBL24939909 0.85 ADORA2A (0.46) ADORA2AADORA3ADORA1ADORA2BADA
SCHEMBL12194724 0.82 ADORA3 (0.53) ADORA2AADORA3ADORA1ADORA2BALOX15
SCHEMBL12219189 0.82 ADORA3 (0.53) ADORA2AADORA3ADORA1ADORA2BALOX15
SCHEMBL18061772 0.82 ADORA3 (0.53) ADORA2AADORA3ADORA1ADORA2BALOX15
SCHEMBL29722602 0.82 ADORA3 (0.53) ADORA2AADORA3ADORA1ADORA2BALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230017958-A1 2'-SUBSTITUTED-N6-SUBSTITUTED PURINE NUCLEOTIDES FOR RNA VIRUS TREATMENT Atea Pharmaceuticals, Inc. (US) 2023-01-19 US disclosed
EP-3512863-B1 2'-SUBSTITUTED-N6-SUBSTITUTED PURINE NUCLEOTIDES FOR RNA VIRUS TREATMENT ATEA PHARMACEUTICALS INC (US) 2021-12-08 EP disclosed
US-10946033-B2 2′-substituted-N6-substituted purine nucleotides for RNA virus treatment Atea Pharmaceuticals, Inc. (US) 2021-03-16 US disclosed
US-20200222442-A1 2'-SUBSTITUTED-N6-SUBSTITUTED PURINE NUCLEOTIDES FOR RNA VIRUS TREATMENT Atea Pharmaceuticals, Inc. (US) 2020-07-16 US disclosed
US-20190201433-A1 2'-SUBSTITUTED-N6-SUBSTITUTED PURINE NUCLEOTIDES FOR RNA VIRUS TREATMENT Atea Pharmaceuticals, Inc. (US) 2019-07-04 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 (4 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-20200222442-A1 2'-SUBSTITUTED-N6-SUBSTITUTED PURINE NUCLEOTIDES FOR RNA VIRUS TREATMENT NSUN2, ADAR, NSUN3 ADORA2A 31/4885ADORA3 59/4885ADORA1 115/4885
US-10946033-B2 2′-substituted-N6-substituted purine nucleotides for RNA virus treatment NSUN2, ADAR, NSUN3 ADORA2A 32/4885ADORA3 67/4885ADORA1 121/4885
US-20190201433-A1 2'-SUBSTITUTED-N6-SUBSTITUTED PURINE NUCLEOTIDES FOR RNA VIRUS TREATMENT NSUN2, ADAR, NSUN3 ADORA2A 31/4885ADORA3 59/4885ADORA1 115/4885
US-20230017958-A1 2'-SUBSTITUTED-N6-SUBSTITUTED PURINE NUCLEOTIDES FOR RNA VIRUS TREATMENT NSUN2, ADAR, NSUN3 ADORA2A 31/4885ADORA3 59/4885ADORA1 115/4885

“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.