SCHEMBL2102610

SCHEMBL2102610

OC[C@H]1O[C@@H](c2coc3c(NCC(O)O)ncnc23)[C@H](O)[C@@H]1O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 4/20 0.41
ADORA2A P29274 2/20 0.41
ADORA1 P30542 2/20 0.41
ADORA2B P29275 1/20 0.41
HIF1A Q16665 1/20 0.39
TP53 P04637 3/20 0.36
PAX8 Q06710 2/20 0.36
SLC29A1 Q99808 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MITF O75030 1/20 0.36
LMNA P02545 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TSHR P16473 1/20 0.36
NFKB1 P19838 1/20 0.36
STAT6 P42226 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
SCHEMBL259659 0.87 HIF1A (0.40) ADORA3ADORA2AADORA1HIF1ASLC29A1
SCHEMBL2102027 0.87 HIF1A (0.40) ADORA3ADORA2AADORA1HIF1ATP53
SCHEMBL259660 0.87 HIF1A (0.40) ADORA3ADORA2AADORA1HIF1ASLC29A1
SCHEMBL260316 0.85 SLC29A1 (0.44) ADORA3ADORA2AADORA1HIF1ASLC29A1
SCHEMBL2102757 0.85 SLC29A1 (0.42) ADORA3ADORA2AADORA1HIF1ASLC29A1
SCHEMBL2102770 0.85 SLC29A1 (0.42) ADORA3ADORA2AADORA1HIF1ASLC29A1
SCHEMBL260317 0.85 SLC29A1 (0.44) ADORA3ADORA2AADORA1HIF1ASLC29A1
SCHEMBL260214 0.84 ADK (0.43) ADORA3ADORA1HIF1A
SCHEMBL260216 0.84 ADK (0.43) ADORA3ADORA1HIF1A
SCHEMBL260089 0.83 ADORA3 (0.39) ADORA3ADORA2AADORA1ADORA2BHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130078218-A1 HEPATITIS C THERAPIES BIOCRYST PHARMACEUTICALS, INC. 2013-03-28 US claimed
EP-2537520-A1 Hepatics C therapies Biocryst Pharmaceuticals, Inc. (US) 2012-12-26 EP claimed
US-8163703-B2 Hepatitis C therapies BIOCRYST PHARMACEUTICALS, INC. (US) 2012-04-24 US claimed
US-20100143300-A1 HEPATITIS C THERAPIES WILMINGTON TRUST, NATIONAL ASSOCIATION 2010-06-10 US claimed
US-7514410-B2 Hepatitis C therapies BIOCRYST PHARMACEUTICALS, INC. (US) 2009-04-07 US claimed
US-20060234963-A1 Hepatitis C therapies WILMINGTON TRUST, NATIONAL ASSOCIATION 2006-10-19 US claimed
US-20130078218-A1 HEPATITIS C THERAPIES BIOCRYST PHARMACEUTICALS, INC. 2013-03-28 US disclosed
EP-2537520-A1 Hepatics C therapies Biocryst Pharmaceuticals, Inc. (US) 2012-12-26 EP disclosed
US-8163703-B2 Hepatitis C therapies BIOCRYST PHARMACEUTICALS, INC. (US) 2012-04-24 US disclosed
US-20100143300-A1 HEPATITIS C THERAPIES WILMINGTON TRUST, NATIONAL ASSOCIATION 2010-06-10 US disclosed
US-7514410-B2 Hepatitis C therapies BIOCRYST PHARMACEUTICALS, INC. (US) 2009-04-07 US disclosed
US-20060234963-A1 Hepatitis C therapies WILMINGTON TRUST, NATIONAL ASSOCIATION 2006-10-19 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 (3 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-20130078218-A1 HEPATITIS C THERAPIES HAVCR2, FABP1, LIPC ADORA3 802/4885ADORA2A 1148/4885ADORA1 1570/4885
US-20060234963-A1 Hepatitis C therapies HAVCR2, FABP1, LIPC ADORA3 802/4885ADORA2A 1148/4885ADORA1 1570/4885
US-20100143300-A1 HEPATITIS C THERAPIES HAVCR2, FABP1, LIPC ADORA3 802/4885ADORA2A 1148/4885ADORA1 1570/4885

“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.