SCHEMBL1897828

SCHEMBL1897828

Nc1nc(N)c2ncn([C@@H]3O[C@H](CO)C(O)C3F)c2n1

nearest known ligand 0.80

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 7/20 0.80
ADORA3 P0DMS8 4/20 0.80
ADORA1 P30542 3/20 0.80
PDE2A O00408 1/20 0.80
ADRA1A P35348 1/20 0.80
PDE4D Q08499 1/20 0.80
PDE3A Q14432 1/20 0.80
LMNA P02545 1/20 0.67
NT5E P21589 1/20 0.67
HIF1A Q16665 1/20 0.67
CD99 P14209 1/20 0.66
SLC29A1 Q99808 1/20 0.63
ADORA2B P29275 4/20 0.62
CYP2C19 P33261 1/20 0.61

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
SCHEMBL1897823 1.00 ADORA2A (0.80) ADORA2AADORA3ADORA1PDE2AADRA1A
SCHEMBL5709816 1.00 ADORA2A (0.80) ADORA2AADORA3ADORA1PDE2AADRA1A
SCHEMBL12667516 1.00 ADORA2A (0.80) ADORA2AADORA3ADORA1PDE2AADRA1A
SCHEMBL29403114 1.00 ADORA2A (0.80) ADORA2AADORA3ADORA1PDE2AADRA1A
SCHEMBL12223712 1.00 ADORA2A (0.80) ADORA2AADORA3ADORA1PDE2AADRA1A
SCHEMBL1897825 1.00 ADORA2A (0.80) ADORA2AADORA3ADORA1PDE2AADRA1A
SCHEMBL24233629 1.00 ADORA2A (0.80) ADORA2AADORA3ADORA1PDE2AADRA1A
SCHEMBL15544938 1.00 ADORA2A (0.80) ADORA2AADORA3ADORA1PDE2AADRA1A
SCHEMBL24233566 0.90 ADORA3 (0.68) ADORA2AADORA3ADORA1PDE2AADRA1A
SCHEMBL24233601 0.90 ADORA3 (0.68) ADORA2AADORA3ADORA1PDE2AADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220033432-A1 ANTI-HEPATITIS B VIRUS AGENT DAIKIN INDUSTRIES, LTD. (JP) 2022-02-03 US disclosed
US-20110257244-A1 CHEMICALLY MODIFIED OLIGONUCLEOTIDES AND SMALL MOLECULES FOR USE IN REDUCING MICRO RNA ACTIVITY LEVELS AND USES THEREOF ALNYLAM PHARMACEUTICALS, INC. (US) 2011-10-20 US disclosed
US-20110257244-A1 CHEMICALLY MODIFIED OLIGONUCLEOTIDES AND SMALL MOLECULES FOR USE IN REDUCING MICRO RNA ACTIVITY LEVELS AND USES THEREOF ALNYLAM PHARMACEUTICALS, INC. (US) 2011-10-20 US disclosed
US-20110130440-A1 NON-NATURAL RIBONUCLEOTIDES, AND METHODS OF USE THEREOF ALNYLAM PHARMACEUTICALS, INC. (US) 2011-06-02 US disclosed
US-20110118339-A1 CHEMICALLY MODIFIED OLIGONUCLEOTIDES AND USES THEREOF ALNYLAM PHARMACEUTICALS, INC. (US) 2011-05-19 US disclosed
US-20110118339-A1 CHEMICALLY MODIFIED OLIGONUCLEOTIDES AND USES THEREOF ALNYLAM PHARMACEUTICALS, INC. (US) 2011-05-19 US disclosed
US-20110065774-A1 CHEMICALLY MODIFIED OLIGONUCLEOTIDES AND USES THEREOF ALNYLAM PHARMACEUTICALS (US) 2011-03-17 US disclosed
US-20110065774-A1 CHEMICALLY MODIFIED OLIGONUCLEOTIDES AND USES THEREOF ALNYLAM PHARMACEUTICALS (US) 2011-03-17 US disclosed
WO-2010101951-A1 NUCLEIC ACID CHEMICAL MODIFICATIONS ALNYLAM PHARMACEUTICALS, INC. (US) 2010-09-10 WO disclosed
WO-2009099942-A2 CHEMICALLY MODIFIED OLIGONUCLEOTIDES AND USES THEREOF ALNYLAM PHARMACEUTICALS, INC. (US) 2009-08-13 WO disclosed
WO-2009099942-A2 CHEMICALLY MODIFIED OLIGONUCLEOTIDES AND USES THEREOF ALNYLAM PHARMACEUTICALS, INC. (US) 2009-08-13 WO disclosed
WO-2009091982-A1 MIR-122 AGONIST ALNYLAM PHARMACEUTICALS, INC. (US) 2009-07-23 WO disclosed
WO-2009091972-A2 CHEMICALLY MODIFIED OLIGONUCLEOTIDES AND SMALL MOLECULES FOR USE IN REDUCING MICRO RNA ACTIVITY LEVELS AND USES THEREOF ALNYLAM PHARMACEUTICALS, INC. (US) 2009-07-23 WO disclosed
WO-2009091982-A1 MIR-122 AGONIST ALNYLAM PHARMACEUTICALS, INC. (US) 2009-07-23 WO disclosed
WO-2009091972-A2 CHEMICALLY MODIFIED OLIGONUCLEOTIDES AND SMALL MOLECULES FOR USE IN REDUCING MICRO RNA ACTIVITY LEVELS AND USES THEREOF ALNYLAM PHARMACEUTICALS, INC. (US) 2009-07-23 WO disclosed
EP-1395266-A1 ANTIVIRAL NUCLEOSIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2004-03-10 EP disclosed
US-6660721-B2 Treatment or prophylaxis of hepatitis C virus infections; viricides HOFFMANN-LA ROCHE INC. 2003-12-09 US disclosed
US-20030083307-A1 Anti-HCV nucleoside derivatives F.HOFFMANN-LA ROCHE AG (CH) 2003-05-01 US disclosed
WO-2002094289-A1 ANTIVIRAL NUCLEOSIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-11-28 WO 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 (6 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-20110257244-A1 CHEMICALLY MODIFIED OLIGONUCLEOTIDES AND SMALL MOLECULES FOR USE IN REDUCING MICRO RNA ACTIVITY LEVELS AND USES THEREOF AGO2, BCDIN3D, TRDMT1 ADORA2A 2390/4885ADORA3 1677/4885ADORA1 2942/4885
US-20030083307-A1 Anti-HCV nucleoside derivatives HAVCR2, EIF2AK2, NSUN2 ADORA2A 167/4885ADORA3 120/4885ADORA1 310/4885
US-20110065774-A1 CHEMICALLY MODIFIED OLIGONUCLEOTIDES AND USES THEREOF DCLRE1B, RNGTT, NSUN2 ADORA2A 755/4885ADORA3 1023/4885ADORA1 1943/4885
US-20220033432-A1 ANTI-HEPATITIS B VIRUS AGENT SLC10A1, HAVCR2, FABP1 ADORA2A 1834/4885ADORA3 1331/4885ADORA1 801/4885
US-20110130440-A1 NON-NATURAL RIBONUCLEOTIDES, AND METHODS OF USE THEREOF NSUN2, RNMT, RNGTT ADORA2A 354/4885ADORA3 499/4885ADORA1 766/4885
US-20110118339-A1 CHEMICALLY MODIFIED OLIGONUCLEOTIDES AND USES THEREOF TRDMT1, NSUN3, BCDIN3D ADORA2A 957/4885ADORA3 745/4885ADORA1 1128/4885

“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.