SCHEMBL42104

SCHEMBL42104

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

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
SCHEMBL21067751 1.00 P2RY1 (0.83) P2RY1P2RY2ADORA1SRCSMN1; SMN2
SCHEMBL1061029 1.00 P2RY1 (0.83) P2RY1P2RY2ADORA1SRCSMN1; SMN2
SCHEMBL29431883 1.00 P2RY1 (0.83) P2RY1P2RY2ADORA1SRCSMN1; SMN2
SCHEMBL31266503 1.00 P2RY1 (0.83) P2RY1P2RY2ADORA1SRCSMN1; SMN2
SCHEMBL15498428 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 817 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4747627-A1 METHODS AND SYSTEMS FOR PREDICTIVE CLASSIFICATION BY MASS SPECTROMETRY AND TRAINED LARGE SPECTRAL MODELS Matterworks Inc (US) 2026-05-27 EP claimed
US-20250290051-A1 MUTATED SULFOTRANSFERASES AND USES THEREOF SANOFI SA (FR) 2025-09-18 US claimed
WO-2025019764-A1 METHODS AND SYSTEMS FOR PREDICTIVE CLASSIFICATION BY MASS SPECTROMETRY AND TRAINED LARGE SPECTRAL MODELS MATTERWORKS INC (US) 2025-01-23 WO claimed
US-20250012802-A1 SYSTEMS AND METHODS FOR PREDICTING RESPONSE TO ORAL MINOXIDIL FOR THE TREATMENT OF ANDROGENETIC ALOPECIA FOLLEA INTERNATIONAL 2025-01-09 US claimed
EP-4488388-A1 SYSTEMS AND METHODS FOR PREDICTING RESPONSE TO ORAL MINOXIDIL FOR THE TREATMENT OF ANDROGENETIC ALOPECIA Follea International (US) 2025-01-08 EP claimed
WO-2024239431-A1 METHOD FOR PHOSPHORYLATION OF NUCLEIC ACID AT 3' END AND LIBRARY CONSTRUCTION 深圳华大智造科技股份有限公司 2024-11-28 WO claimed
EP-4437319-A1 METHODS AND COMPOSITIONS FOR ANALYTE QUANTIFICATION Matterworks Inc (US) 2024-10-02 EP claimed
EP-4408988-A1 USES AND METHODS FOR SULFATING A SUBSTRATE WITH A MUTATED ARYLSULFOTRANSFERASE Sanofi (FR) 2024-08-07 EP claimed
EP-4408987-A2 MUTATED SULFOTRANSFERASES AND USES THEREOF Sanofi (FR) 2024-08-07 EP claimed
CN-118339282-A Use and method of sulfating a substrate with a mutated arylsulftransferase 赛诺菲 2024-07-12 CN claimed
EP-0739630-B1 Process for the simultaneous elimination of tumor necrosis factor alpha and bacterial lipopolysaccharides from whole blood and/or blood plasma BRAUN MELSUNGEN AG (DE) 2003-03-12 EP claimed
US-6436407-B1 E. COLI HEAT-LABILE ENTEROTOXIN WHICH HAS LOST ITS TOXICITY BUT HAS RETAINED ITS IMMUNOLOGIC ACTIVITY THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND 2002-08-20 US claimed
EP-0592989-B1 Process of the selective and quantitative removal or preparation of tumor necrosis factor (TNF) and lipopolysaccharides (LPS) of aqueous solutions BRAUN MELSUNGEN AG (DE) 2002-05-08 EP claimed
US-6372724-B1 MODULATING HISTAMINE RELEASE; CONTACTING MAST CELLS WITH AGENT WHICH INHIBITS ADENOSINE TRIPHOSPHATE (ATP) FROM BINDING TO P2-PURINOCEPTORS; TREATING ASTHMA AND ALLERGIES DUSKA SCIENTIFIC CO. 2002-04-16 US claimed
US-6255088-B1 Enzymatic sulfation of biomolecules THE SCRIPPS RESEARCH INSTITUTE 2001-07-03 US claimed
EP-0693553-B1 Heparan sulfate 6-0-sulfotransferase SEIKAGAKU KOGYO CO LTD (JP) 1998-10-14 EP claimed
EP-0739630-A2 Process and apparatus for the simultaneous elimination of tumor necrosis factor aplha and bacterial lipopolysaccharides from whole blood and/or blood plasma B. BRAUN MELSUNGEN AG (DE) 1996-10-30 EP claimed
EP-0592989-A2 Process of the selective and quantitative removal or preparation of tumor necrosis factor (TNF) and/or lipopolysaccharides (LPS) of aqueous solutions B. BRAUN MELSUNGEN AG (DE) 1994-04-20 EP claimed
EP-0178113-B1 REAGENT FOR ASSAYING CREATINE KINASE UNITIKA LTD. (JP) 1989-05-03 EP claimed
US-4157440-A TREATMENT OF CARDIAC HYPERTROPHY; REACTION OF GLUCOSAMINE WITH CAMP MARXER S.P.A. (IT) 1979-06-05 US claimed