SCHEMBL13598733

SCHEMBL13598733

CC1(O)[C@H](O)[C@@H](CO)O[C@H]1n1ccc2c(Cl)ncnc21

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 7/20 0.55
▸ ADORA3 P0DMS8 7/20 0.52
▸ ADORA1 P30542 4/20 0.48
▸ ADORA2B P29275 3/20 0.48
▸ PRMT5 O14744 8/20 0.45
▸ WDR77 Q9BQA1 8/20 0.45
▸ ALOX15 P16050 1/20 0.44

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
SCHEMBL1738408 1.00 ADORA2A (0.55) ADORA2AADORA3ADORA1ADORA2BPRMT5
SCHEMBL4430217 1.00 ADORA2A (0.55) ADORA2AADORA3ADORA1ADORA2BPRMT5
SCHEMBL13598781 1.00 ADORA2A (0.55) ADORA2AADORA3ADORA1ADORA2BPRMT5
SCHEMBL14440600 0.92 ADORA2A (0.47) ADORA2AADORA3PRMT5WDR77
SCHEMBL1740552 0.89 ADORA2A (0.43) ADORA2AADORA3PRMT5WDR77
SCHEMBL18661709 0.88 ADORA2A (0.42) ADORA2AADORA3PRMT5WDR77
SCHEMBL18661710 0.88 ADORA2A (0.42) ADORA2AADORA3PRMT5WDR77
SCHEMBL12219557 0.88 ADORA2A (0.42) ADORA2AADORA3PRMT5WDR77
SCHEMBL12194659 0.88 ADORA2A (0.42) ADORA2AADORA3PRMT5WDR77
SCHEMBL16311924 0.87 ADORA2A (0.56) ADORA2AADORA3ADORA1ADORA2BPRMT5

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-7629328-B2 Nucleoside derivatives for treating hepatitis C virus infection SMITHKLINE BEECHAM CORPORATION (US) 2009-12-08 — — US disclosed
US-20090036399-A1 NUCLEOSIDE DERIVATIVES FOR TREATING HEPATITIS C VIRUS INFECTION GENELABS TECHNOLOGIES, INC. 2009-02-05 — — US disclosed
US-7432248-B2 Nucleoside derivatives for treating Hepatitis C virus infection GENELABS TECHNOLOGIES, INC. (US) 2008-10-07 — — US disclosed
US-7414031-B2 5-nitro-nucleoside compounds for treating viral infections GENELABS TECHNOLOGIES, INC. (US) 2008-08-19 — — US disclosed
US-7414031-B2 5-nitro-nucleoside compounds for treating viral infections GENELABS TECHNOLOGIES, INC. (US) 2008-08-19 — — 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 (1 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-20090036399-A1 NUCLEOSIDE DERIVATIVES FOR TREATING HEPATITIS C VIRUS INFECTION HAVCR2, PNP, NSUN2 ADORA2A 45/4885ADORA3 55/4885ADORA1 105/4885

“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.

Send feedback