SCHEMBL7677945

SCHEMBL7677945

Nc1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@H]2O)c(=O)n1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RNASEL Q05823 13/20 0.76
DNPH1 O43598 1/20 0.70
PRKAB2 O43741 1/20 0.70
TRPM2 O94759 1/20 0.70
LDHA P00338 1/20 0.70
ADRB2 P07550 1/20 0.70
FBP1 P09467 1/20 0.70
SRC P12931 1/20 0.70
ADORA1 P30542 1/20 0.70
P2RY2 P41231 1/20 0.70
P2RY1 P47900 1/20 0.70
PRKAG1 P54619 1/20 0.70
PRKAA2 P54646 1/20 0.70
PDE4D Q08499 1/20 0.70
KCNH2 Q12809 1/20 0.70
PRKAA1 Q13131 1/20 0.70
PDE3A Q14432 1/20 0.70
SMN1; SMN2 Q16637 1/20 0.70
TAS1R3 Q7RTX0 1/20 0.70
TAS1R1 Q7RTX1 1/20 0.70

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
SCHEMBL432628 0.94 RNASEL (0.67) RNASELDNPH1PRKAB2TRPM2LDHA
Adenosine Phosphate SCHEMBL28920925 0.94 P2RY1 (0.80) RNASELDNPH1PRKAB2TRPM2LDHA
Adenosine Phosphate SCHEMBL29390023 0.94 P2RY1 (0.80) RNASELDNPH1PRKAB2TRPM2LDHA
SCHEMBL29354270 0.93 RNASEL (0.65) RNASELADORA1
Adenosine Phosphate SCHEMBL6264787 0.92 P2RY1 (0.73) RNASELDNPH1PRKAB2TRPM2LDHA
SCHEMBL6689687 0.92 P2RY1 (0.74) RNASELDNPH1PRKAB2TRPM2LDHA
SCHEMBL21527728 0.92 RNASEL (0.63) RNASELDNPH1PRKAB2TRPM2LDHA
SCHEMBL20604358 0.92 RNASEL (0.63) RNASELDNPH1PRKAB2TRPM2LDHA
SCHEMBL21837529 0.92 RNASEL (0.63) RNASELDNPH1PRKAB2TRPM2LDHA
SCHEMBL21527725 0.92 RNASEL (0.63) RNASELDNPH1PRKAB2TRPM2LDHA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200131669-A1 CYCLIC PEPTIDE COMPOUND HAVING HIGH MEMBRANE PERMEABILITY, AND LIBRARY CONTAINING SAME CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2020-04-30 US disclosed
US-6500652-B2 OLIGONUCLEOTIDE OF >/=4 NUCLEOTIDES THAT HAS A VIRAL NUCLEIC ACID SEQUENCE WHICH INCLUDES THE INITIATION NUCLEOTIDE ADVANCED RESEARCH AND TECHNOLOGY INSTITUTE, INC. 2002-12-31 US disclosed
US-20020103143-A1 USE OF NUCLEIC ACID MOLECULES AS ANTIVIRAL AGENTS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORP. 2002-08-01 US disclosed
EP-1098969-A2 USE OF NUCLEIC ACID MOLECULES AS ANTIVIRAL AGENTS RIBOZYME PHARMACEUTICALS, INC. (US) 2001-05-16 EP disclosed
WO-2000004141-A2 USE OF NUCLEIC ACID MOLECULES AS ANTIVIRAL AGENTS RIBOZYME PHARMACEUTICALS, INC. (US) 2000-01-27 WO disclosed
WO-1999049085-A9 USE OF A VIRAL POLYMERASE TO AMPLIFY NUCLEIC ACIDS ADVANCED RES & TECH INST (US) 1999-11-25 WO disclosed
WO-1999049085-A1 USE OF A VIRAL POLYMERASE TO AMPLIFY NUCLEIC ACIDS ADVANCED RESEARCH AND TECHNOLOGY INSTITUTE, INC. (US) 1999-09-30 WO disclosed
WO-1999049031-A1 USE OF NUCLEIC ACID MOLECULES AS ANTIVIRAL AGENTS ADVANCED RESEARCH AND TECHNOLOGY INSTITUTE, INC. (US) 1999-09-30 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 (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-20200131669-A1 CYCLIC PEPTIDE COMPOUND HAVING HIGH MEMBRANE PERMEABILITY, AND LIBRARY CONTAINING SAME VIP, SLC7A1, TRPV1 RNASEL 4339/4885DNPH1 2457/4885PRKAB2 3036/4885

“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.