SCHEMBL2102602

SCHEMBL2102602

CC(O)(O)Nc1ncnc2c(C3O[C@H](CO)[C@@H](O)[C@H]3O)coc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.39
PMP22 Q01453 2/20 0.36
ADORA3 P0DMS8 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
TSHR P16473 1/20 0.36
NFKB1 P19838 1/20 0.36
STAT6 P42226 1/20 0.36
GMNN O75496 1/20 0.36
BLM P54132 1/20 0.36
LMNA P02545 2/20 0.35
ALDH1A1 P00352 1/20 0.35
GLA P06280 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPC1 O15118 1/20 0.35
NPY1R P25929 1/20 0.35
HTT P42858 1/20 0.35
NPY2R P49146 1/20 0.35
RAB9A P51151 1/20 0.35
SLC29A1 Q99808 1/20 0.35

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
SCHEMBL260216 0.86 ADK (0.43) HIF1AADORA3ADORA1RXFP1
SCHEMBL260214 0.86 ADK (0.43) HIF1AADORA3ADORA1RXFP1
SCHEMBL259660 0.84 HIF1A (0.40) HIF1APMP22ADORA3ADORA2AADORA1
SCHEMBL259659 0.84 HIF1A (0.40) HIF1APMP22ADORA3ADORA2AADORA1
SCHEMBL260090 0.83 ADORA3 (0.39) HIF1APMP22ADORA3ADORA2AADORA1
SCHEMBL260089 0.83 ADORA3 (0.39) HIF1APMP22ADORA3ADORA2AADORA1
SCHEMBL260316 0.83 SLC29A1 (0.44) HIF1AADORA3ADORA2AADORA1TSHR
SCHEMBL260317 0.83 SLC29A1 (0.44) HIF1AADORA3ADORA2AADORA1TSHR
SCHEMBL2102027 0.82 HIF1A (0.40) HIF1AADORA3ADORA2AADORA1TSHR
SCHEMBL2101890 0.82 ADORA3 (0.42) HIF1APMP22ADORA3ADORA2AADORA1

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 HIF1A 636/4885PMP22 3679/4885ADORA3 802/4885
US-20060234963-A1 Hepatitis C therapies HAVCR2, FABP1, LIPC HIF1A 636/4885PMP22 3679/4885ADORA3 802/4885
US-20100143300-A1 HEPATITIS C THERAPIES HAVCR2, FABP1, LIPC HIF1A 636/4885PMP22 3679/4885ADORA3 802/4885

“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.