SCHEMBL459997

SCHEMBL459997

Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)C(O)C2O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY1 P47900 7/20 0.84
P2RY2 P41231 4/20 0.84
P2RX1 P51575 4/20 0.84
P2RX3 P56373 4/20 0.84
SRC P12931 2/20 0.84
SMN1; SMN2 Q16637 2/20 0.84
P2RX2 Q9UBL9 2/20 0.84
ALDH1A1 P00352 2/20 0.84
P2RX4 Q99571 1/20 0.84
TRPM2 O94759 2/20 0.80
TAS1R3 Q7RTX0 2/20 0.80
TAS1R1 Q7RTX1 2/20 0.80
DNPH1 O43598 1/20 0.80
PRKAB2 O43741 1/20 0.80
LDHA P00338 1/20 0.80
ADRB2 P07550 1/20 0.80
FBP1 P09467 1/20 0.80
ADORA1 P30542 1/20 0.80
PRKAG1 P54619 1/20 0.80
PRKAA2 P54646 1/20 0.80

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
SCHEMBL1746647 1.00 P2RY1 (0.84) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL459771 1.00 P2RY1 (0.84) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL10396861 0.99 P2RY1 (0.86) P2RY1P2RY2P2RX1P2RX3SRC
Water SCHEMBL9225179 0.99 P2RY1 (0.82) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL3792441 0.99 P2RY1 (0.82) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL5838786 0.99 P2RY1 (0.82) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL28646263 0.98 P2RY1 (0.84) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL28367704 0.98 P2RY1 (0.84) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL6242721 0.98 P2RY1 (0.84) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL27962220 0.97 P2RY1 (0.80) P2RY1P2RY2P2RX1P2RX3SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112881311-B Creatine kinase detection reagent, kit and detection method 深圳迈瑞生物医疗电子股份有限公司 2025-05-30 CN claimed
CN-114480567-B Anti-heparin interference creatine kinase biochemical detection reagent 天津中成佳益生物科技有限公司 2024-01-26 CN claimed
EP-4240339-A1 COMPOSITIONS AND METHODS TO PROMOTE THYMIC FUNCTION Fred Hutchinson Cancer Center (US) 2023-09-13 EP claimed
US-20230263800-A1 COMPOSITIONS AND METHODS TO PROMOTE THYMIC FUNCTION FRED HUTCHINSON CANCER CENTER (US) 2023-08-24 US claimed
CN-115558703-A Creatine kinase detection kit for resisting lipidemia interference and preparation method thereof 青岛汉唐生物科技有限公司 2023-01-03 CN claimed
CN-114721457-A Low-temperature coefficient resistance-free band gap reference source 浙江大学 2022-07-08 CN claimed
WO-2022098776-A1 COMPOSITIONS AND METHODS TO PROMOTE THYMIC FUNCTION FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2022-05-12 WO claimed
CN-112539696-B Depolarization compensation method for prism of self-reference interferometer 中国科学院微电子研究所 2022-04-29 CN claimed
CN-112881311-A Creatine kinase detection reagent, kit and detection method 深圳迈瑞生物医疗电子股份有限公司 2021-06-01 CN claimed
US-8608922-B2 Biosensor for continuous monitoring of metabolites and proteins and methods of manufacture thereof THE UNIVERSITY OF CONNECTICUT (US) 2013-12-17 US claimed
US-20040135997-A1 Metal coated nanocrystalline silicon as an active surface enhanced raman spectroscopy (SERS) substrate INTEL CORPORATION 2004-07-15 US claimed
EP-0969848-A1 USE OF DIADENOSINE POLYPHOSPHATES FOR REDUCING BLOOD PRESSURE Clemson University (US) 2000-01-12 EP claimed
WO-1998030222-A1 USE OF DIADENOSINE POLYPHOSPHATES FOR REDUCING BLOOD PRESSURE CLEMSON UNIVERSITY (US) 1998-07-16 WO claimed
EP-0721986-A2 Creatine kinase reagent WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 1996-07-17 EP claimed
US-5009994-A Uniform distribution EM DIAGNOSTIC SYSTEMS, INC. (US) 1991-04-23 US claimed
US-4810639-A CREATINE KINASE ISOENZYMES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-03-07 US claimed
EP-0227440-A2 Immunoassay for creatine kinase MB using bound and soluble antibodies E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-07-01 EP claimed
EP-0015437-B1 METHOD AND REAGENT FOR THE DETERMINATION OF CREATINE KINASE Roche Diagnostics GmbH (DE) 1981-11-25 EP claimed
EP-0008341-B1 METHOD AND REAGENT FOR ENZYMATIC DETERMINATIONS AND TEST KIT FOR THIS METHOD Roche Diagnostics GmbH (DE) 1981-11-04 EP claimed
US-4286057-A QUANTITATIVE ANALYSIS OF CREATINE KINASE USING THE LUMINESCENT SYSTEM OF THE FIREFLY BOEHRINGER MANNHEIM GMBH (DE) 1981-08-25 US claimed

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-20230263800-A1 COMPOSITIONS AND METHODS TO PROMOTE THYMIC FUNCTION BMP4, P2RY2, GPR39 P2RY1 6/4885P2RY2 2/4885P2RX1 17/4885

“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.