SCHEMBL1061029

SCHEMBL1061029

Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)C(OP(=O)(O)O)C1O

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 4/20 0.83
▸ P2RY2 P41231 3/20 0.83
▸ ADORA1 P30542 2/20 0.83
▸ SRC P12931 2/20 0.83
▸ SMN1; SMN2 Q16637 2/20 0.83
▸ DNPH1 O43598 1/20 0.83
▸ PRKAB2 O43741 1/20 0.83
▸ TRPM2 O94759 1/20 0.83
▸ LDHA P00338 1/20 0.83
▸ ADRB2 P07550 1/20 0.83
▸ FBP1 P09467 1/20 0.83
▸ PRKAG1 P54619 1/20 0.83
▸ PRKAA2 P54646 1/20 0.83
▸ PDE4D Q08499 1/20 0.83
▸ KCNH2 Q12809 1/20 0.83
▸ PRKAA1 Q13131 1/20 0.83
▸ PDE3A Q14432 1/20 0.83
▸ TAS1R3 Q7RTX0 1/20 0.83
▸ TAS1R1 Q7RTX1 1/20 0.83
▸ P2RY11 Q96G91 1/20 0.83

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
SCHEMBL15498428 1.00 P2RY1 (0.83) P2RY1P2RY2ADORA1SRCSMN1; SMN2
SCHEMBL31266503 1.00 P2RY1 (0.83) P2RY1P2RY2ADORA1SRCSMN1; SMN2
SCHEMBL29431883 1.00 P2RY1 (0.83) P2RY1P2RY2ADORA1SRCSMN1; SMN2
SCHEMBL42104 1.00 P2RY1 (0.83) P2RY1P2RY2ADORA1SRCSMN1; SMN2
SCHEMBL21067751 1.00 P2RY1 (0.83) P2RY1P2RY2ADORA1SRCSMN1; SMN2
SCHEMBL23867092 1.00 P2RY1 (0.83) P2RY1P2RY2ADORA1SRCSMN1; SMN2
Water SCHEMBL17159664 0.99 P2RY1 (0.81) P2RY1P2RY2ADORA1SRCSMN1; SMN2
Sulfuric Acid SCHEMBL11187808 0.96 P2RY1 (0.77) P2RY1P2RY2ADORA1SRCSMN1; SMN2
SCHEMBL4360139 0.95 P2RY1 (0.75) P2RY1P2RY2ADORA1SRCSMN1; SMN2
SCHEMBL24059958 0.94 ADORA1 (0.76) P2RY1P2RY2ADORA1SRCSMN1; SMN2

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 133 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2501816-A1 PLANTS WITH INCREASED YIELD BASF Plant Science Company GmbH (DE) 2012-09-26 — — EP claimed
US-20120227134-A1 Plants with Increased Yield BASF PLANT SCIENCE COMPANY GMBH (DE) 2012-09-06 — — US claimed
WO-2011061656-A1 PLANTS WITH INCREASED YIELD BASF PLANT SCIENCE COMPANY GMBH (DE) 2011-05-26 — — WO claimed
EP-2312319-A1 Process of screening a molecule as a candidate drug for the treatment of bipolar disorder INSTITUT PASTEUR (FR) 2011-04-20 — — EP claimed
US-7655445-B2 Synthesis of N-deacetylate N-sulfate derivatives of non-sulfated N-acetyl heparosan (HS) polysaccharides; rapid synthesis; high product yield MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2010-02-02 — — US claimed
US-20100008894-A1 Process of Screening a Molecule as a Candidate Drug for the Treatment of Bipolar Disorder INSTITUTE PASTEUR (FR) 2010-01-14 — — US claimed
EP-1934617-A1 PROCESS OF SCREENING A MOLECULE AS A CANDIDATE DRUG FOR THE TREATMENT OF BIPOLAR DISORDER INSTITUT PASTEUR (FR) 2008-06-25 — — EP claimed
WO-2007039500-A1 PROCESS OF SCREENING A MOLECULE AS A CANDIDATE DRUG FOR THE TREATMENT OF BIPOLAR DISORDER INSTITUT PASTEUR (FR) 2007-04-12 — — WO claimed
EP-1767946-A1 Process of screening a molecule as a candidate drug for the treatment of bipolar disorder INSTITUT PASTEUR (FR) 2007-03-28 — — EP claimed
US-20250243524-A1 METHOD FOR PRODUCING SULFATED POLYSACCHARIDE AND METHOD FOR PRODUCING PAPS KIRIN BIOMATERIALS CO., LTD. (JP) 2025-07-31 — — US disclosed
US-12359232-B2 Biological processes for the production of aryl sulfates CYSBIO APS (DK) 2025-07-15 — — US disclosed
US-12291504-B2 Small molecule inhibition of sulfotransferase SULT1A3 University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2025-05-06 — — US disclosed
US-12264350-B2 Method for producing sulfated polysaccharide and method for producing PAPS RENSSELAER POLYTECHNIC INSTITUTE (US) 2025-04-01 — — US disclosed
EP-3663406-B1 BIOLOGICAL PROCESSES FOR THE PRODUCTION OF ARYL SULFATES CYSBIO APS (DK) 2025-02-26 — — EP disclosed
US-5741668-A SYNTHESIZING COELENTERAZINE, A BIOLUMINESCENT COMPOUND RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 1998-04-21 — — US disclosed
US-5716836-A Anti-sulfated tyrosine antibody specific for sulfated tyrosine, process for producing the same, and hybridoma capable of producing anti-sulfated tyrosine monoclonal antibody specific for sulfated tyrosine UNITIKA LTD. (JP) 1998-02-10 — — US disclosed
EP-0817862-A1 ONE-POT ENZYMATIC SULFATION PROCESS USING 3'-PHOSPHOADENOSINE-5'-PHOSPHOSULFATE AND RECYCLED PHOSPHORYLATED ADENOSINE INTERMEDIATES THE SCRIPPS RESEARCH INSTITUTE (US) 1998-01-14 — — EP disclosed
WO-1996029424-A9 ONE-POT ENZYMATIC SULFATION PROCESS USING 3'-PHOSPHOADENOSINE-5'-PHOSPHOSULFATE AND RECYCLED PHOSPHORYLATED ADENOSINE INTERMEDIATES — 1996-11-21 — — WO disclosed
WO-1996029424-A1 ONE-POT ENZYMATIC SULFATION PROCESS USING 3'-PHOSPHOADENOSINE-5'-PHOSPHOSULFATE AND RECYCLED PHOSPHORYLATED ADENOSINE INTERMEDIATES THE SCRIPPS RESEARCH INSTITUTE (US) 1996-09-26 — — WO disclosed
WO-1995021191-A1 BIOLUMINESCENT INDICATOR BASED UPON THE EXPRESSION OF A GENE FOR A MODIFIED GREEN-FLUORESCENT PROTEIN WARD WILLIAM (US) 1995-08-10 — — 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-12291504-B2 Small molecule inhibition of sulfotransferase SULT1A3 SULT1A1, SULT2A1, SULT1E1 P2RY1 4560/4885P2RY2 4549/4885ADORA1 3496/4885

“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.

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