SCHEMBL1757017

SCHEMBL1757017

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

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 3/20 0.73
SMN1; SMN2 Q16637 3/20 0.73
ADORA3 P0DMS8 2/20 0.73
ADORA2A P29274 2/20 0.73
ADORA2B P29275 2/20 0.73
DPP4 P27487 1/20 0.73
MEN1 O00255 1/20 0.73
SLC28A1 O00337 1/20 0.73
MAP3K7 O43318 1/20 0.73
SLC28A2 O43868 1/20 0.73
GAPDH P04406 1/20 0.73
MAPK1 P28482 1/20 0.73
STAT6 P42226 1/20 0.73
PI4KA P42356 1/20 0.73
KMT2A Q03164 1/20 0.73
PI4K2B Q8TCG2 1/20 0.73
DOT1L Q8TEK3 1/20 0.73
SLC29A1 Q99808 1/20 0.73
PI4K2A Q9BTU6 1/20 0.73
SLC28A3 Q9HAS3 1/20 0.73

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
SCHEMBL19859780 1.00 ADORA1 (0.73) ADORA1SMN1; SMN2ADORA3ADORA2AADORA2B
SCHEMBL9426538 0.91 PRKACA (0.73) ADORA1SMN1; SMN2ADORA3ADORA2AADORA2B
SCHEMBL2463542 0.91 PRKACA (0.73) ADORA1SMN1; SMN2ADORA3ADORA2AADORA2B
SCHEMBL5550634 0.90 P2RY1 (0.71) ADORA1SMN1; SMN2ADORA3ADORA2AADORA2B
SCHEMBL31001632 0.90 P2RY1 (0.71) ADORA1SMN1; SMN2ADORA3ADORA2AADORA2B
SCHEMBL219554 0.90 P2RY1 (0.71) ADORA1SMN1; SMN2ADORA3ADORA2AADORA2B
SCHEMBL11584743 0.90 P2RY1 (0.71) ADORA1SMN1; SMN2ADORA3ADORA2AADORA2B
SCHEMBL9295626 0.89 AHCY (0.71) ADORA1SMN1; SMN2ADORA3ADORA2AADORA2B
SCHEMBL9295615 0.89 AHCY (0.71) ADORA1SMN1; SMN2ADORA3ADORA2AADORA2B
SCHEMBL2790606 0.89 PLA2G2A (0.68) ADORA1SMN1; SMN2ADORA3ADORA2AADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7943760-B2 Non-nucleotide composition for inhibiting platelet aggregation INSPIRE PHARMACEUTICALS, INC. (US) 2011-05-17 US disclosed
US-20100197913-A1 NON-NUCLEOTIDE COMPOSITION FOR INHIBITING PLATELET AGGREGATION PLOURDE JR ROBERT 2010-08-05 US disclosed
US-7749980-B2 Non-nucleotide compositions and method for treating pain INSPIRE PHARMACEUTICALS, INC. (US) 2010-07-06 US disclosed
US-7749981-B2 Drug-eluting stents coated with non-nucleotide P2Y12 receptor antagonist compound INSPIRE PHARMACEUTICALS, INC. (US) 2010-07-06 US disclosed
US-7592445-B2 Non-nucleotide composition and method for inhibiting platelet aggregation INSPIRE PHARMACEUTICALS, INC. (US) 2009-09-22 US disclosed
EP-1943261-A2 DRUG-ELUTING STENTS COATED WITH NON-NUCLEOTIDE P2Y12 RECEPTOR ANTAGONIST COMPOUND Inspire Pharmaceuticals, Inc. (US) 2008-07-16 EP disclosed
US-7368438-B2 Non-nucleotide compositions and method for inhibiting platelet aggregation INSPIRE PHARMACEUTICALS, INC. (US) 2008-05-06 US disclosed
US-20080103304-A1 NON-NUCLEOTIDE COMPOSITION AND METHOD FOR INHIBITING PLATELET AGGREGATION PLOURDE ROBERT JR 2008-05-01 US disclosed
US-7335648-B2 Non-nucleotide composition and method for inhibiting platelet aggregation INSPIRE PHARMACEUTICALS, INC. (US) 2008-02-26 US disclosed
EP-1883637-A2 NON-NUCLEOTIDE COMPOSITION AND METHOD FOR INHIBITING PLATELET AGGREGATION Inspire Pharmaceuticals, Inc. (US) 2008-02-06 EP disclosed
US-6335320-B1 Method of treating fibrotic conditions UCB S.A. (BE) 2002-01-01 US disclosed
EP-1111065-A2 Production of saccharide carboxylic acids TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-06-27 EP disclosed
US-5773424-A PARASITICIDE RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1998-06-30 US disclosed
US-5635611-A COMPLEXING DETRANYLGLUCURONIC ACID SALT WITH FERRIC HYDROXIDE SOL TO FORM A COMPLEX; RESISTANT TO ENZYMATIC DEGRADATION AND IMPROVED WATER SOLUBILITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-06-03 US disclosed
US-5635610-A FROM OXIDATION BY A MICROORGANISM BELONGING TO THE GENUS PSEUDOGLUCONOBACTER; RESISTANT TO ENZYMATIC DEGRADATION; IMPROVED WATER SOLUBILITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-06-03 US disclosed
US-5629411-A RESISTANT TO ENZYMATIC DEGRATION, IMPROVED WATER SOLUBILITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-05-13 US disclosed
EP-0755255-A1 TREATMENT OF TOXOPLASMOSIS UNIVERSITY OF ALABAMA, BIRMINGHAM RESEARCH FOUNDATION (US) 1997-01-29 EP disclosed
WO-1996018398-A1 TREATMENT OF TOXOPLASMOSIS THE UNIVERSITY OF ALABAMA AT BIRMINGHAM RESEARCH FOUNDATION (US) 1996-06-20 WO disclosed
US-5434061-A Pseudogluconobacter TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-07-18 US disclosed
EP-0599646-A2 Production of saccharide carboxylic acids TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-06-01 EP 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 (2 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-20080103304-A1 NON-NUCLEOTIDE COMPOSITION AND METHOD FOR INHIBITING PLATELET AGGREGATION P2RY12, P2RY11, P2RY13 ADORA1 21/4885SMN1; SMN2 3640/4885ADORA3 19/4885
US-20100197913-A1 NON-NUCLEOTIDE COMPOSITION FOR INHIBITING PLATELET AGGREGATION P2RY12, P2RY13, P2RY11 ADORA1 23/4885SMN1; SMN2 3502/4885ADORA3 19/4885

“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.