SCHEMBL5320000

SCHEMBL5320000

C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cc(C#C[Si](C)(C)C)c2c(Cl)ncnc21

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 8/20 0.49
ADORA3 P0DMS8 10/20 0.44
ADORA1 P30542 7/20 0.44
ADORA2B P29275 4/20 0.44
ADK P55263 4/20 0.43
SLC29A1 Q99808 1/20 0.43
ALOX15 P16050 1/20 0.40
DOT1L Q8TEK3 1/20 0.37
ADA P00813 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
SCHEMBL14598183 1.00 ADORA2A (0.49) ADORA2AADORA3ADORA1ADORA2BADK
SCHEMBL4425442 1.00 ADORA2A (0.49) ADORA2AADORA3ADORA1ADORA2BADK
SCHEMBL6531303 0.89 ADORA2A (0.50) ADORA2AADORA3ADORA1ADORA2BADK
SCHEMBL5319713 0.88 ADORA2A (0.59) ADORA2AADORA3ADORA1ADORA2BADK
SCHEMBL14453126 0.88 ADORA2A (0.59) ADORA2AADORA3ADORA1ADORA2BADK
SCHEMBL14453221 0.88 ADORA2A (0.59) ADORA2AADORA3ADORA1ADORA2BADK
SCHEMBL14598182 0.88 ADORA2A (0.59) ADORA2AADORA3ADORA1ADORA2BADK
SCHEMBL13604051 0.88 ADORA2A (0.51) ADORA2AADORA3ADORA1ADORA2BADK
SCHEMBL14598195 0.88 ADORA2A (0.51) ADORA2AADORA3ADORA1ADORA2BADK
SCHEMBL5519636 0.88 ADORA2A (0.51) ADORA2AADORA3ADORA1ADORA2BADK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7169918-B2 Methods for preparing 7-(2′-substituted-β-D-ribofuranosyl)-4-(NR2R3)-5-(substituted ethyn-1-yl)-pyrrolo[2,3-d]pyrimidine derivatives GENELABS TECHNOLOGIES, INC. (US) 2007-01-30 US claimed
US-20050215510-A1 Methods for preparing 7-(2'-substituted-beta-D-ribofuranosyl)-4-(NR2R3)-5-(substituted ethyn-1-yl)-pyrrolo[2,3-d]pyrimidine derivatives GENELABS TECHNOLOGIES, INC. 2005-09-29 US claimed
WO-2007084157-A2 NUCLEOSIDE PRODRUGS FOR TREATING VIRAL INFECTIONS GENELABS TECHNOLOGIES, INC. (US) 2007-07-26 WO disclosed
US-7169918-B2 Methods for preparing 7-(2′-substituted-β-D-ribofuranosyl)-4-(NR2R3)-5-(substituted ethyn-1-yl)-pyrrolo[2,3-d]pyrimidine derivatives GENELABS TECHNOLOGIES, INC. (US) 2007-01-30 US disclosed
US-7157434-B2 Nucleoside compounds for treating viral infections GENELABS TECHNOLOGIES, INC. (US) 2007-01-02 US disclosed
US-20050215510-A1 Methods for preparing 7-(2'-substituted-beta-D-ribofuranosyl)-4-(NR2R3)-5-(substituted ethyn-1-yl)-pyrrolo[2,3-d]pyrimidine derivatives GENELABS TECHNOLOGIES, INC. 2005-09-29 US disclosed
US-20050107312-A1 Nucleoside compounds for treating viral infections GENELABS TECHNOLOGIES, INC. 2005-05-19 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 (2 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-20050107312-A1 Nucleoside compounds for treating viral infections PNP, HAVCR2, SAMHD1 ADORA2A 235/4885ADORA3 262/4885ADORA1 475/4885
US-20050215510-A1 Methods for preparing 7-(2'-substituted-beta-D-ribofuranosyl)-4-(NR2R3)-5-(substituted ethyn-1-yl)-pyrrolo[2,3-d]pyrimidine derivatives HAVCR2, NR4A3, NR2C2 ADORA2A 738/4885ADORA3 113/4885ADORA1 1125/4885

“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.