SCHEMBL536779

SCHEMBL536779

NCc1cccc(CO[C@H]2CCOC2)n1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 3/20 0.48
ADORA3 P0DMS8 1/20 0.48
ADORA2B P29275 1/20 0.48
ADORA1 P30542 1/20 0.48
DCPS Q96C86 1/20 0.41
MCHR1 Q99705 1/20 0.34
CXCR4 P61073 1/20 0.33
PDE10A Q9Y233 1/20 0.33
KCNH2 Q12809 1/20 0.33
DRD4 P21917 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
ATF4 P18848 1/20 0.31
GRM4 Q14833 1/20 0.30
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 1/20 0.30

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
SCHEMBL29433976 1.00 ADORA2A (0.48) ADORA2AADORA3ADORA2BADORA1DCPS
SCHEMBL536780 1.00 ADORA2A (0.48) ADORA2AADORA3ADORA2BADORA1DCPS
SCHEMBL1845258 0.87 ADORA2A (0.46) ADORA2AADORA3ADORA2BADORA1DCPS
SCHEMBL1845253 0.87 ADORA2A (0.46) ADORA2AADORA3ADORA2BADORA1DCPS
SCHEMBL20416885 0.86 ADORA2A (0.46) ADORA2AADORA3ADORA2BADORA1DCPS
SCHEMBL18679939 0.86 ADORA2A (0.48) ADORA2AADORA3ADORA2BADORA1DCPS
SCHEMBL22940745 0.86 ADORA2A (0.48) ADORA2AADORA3ADORA2BADORA1DCPS
SCHEMBL22242037 0.86 ADORA2A (0.50) ADORA2AADORA3ADORA2BADORA1DCPS
SCHEMBL536593 0.86 ADORA2A (0.48) ADORA2AADORA3ADORA2BADORA1DCPS
SCHEMBL536592 0.86 ADORA2A (0.48) ADORA2AADORA3ADORA2BADORA1DCPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230100842-A1 TRIAZOLO[4,5-D] PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS LIGAND UK DEVELOPMENT LIMITED (GB) 2023-03-30 US disclosed
US-11466019-B2 Triazolo[4,5-d] pyramidine derivatives and their use as purine receptor antagonists VERNALIS (R&D) LIMITED (GB) 2022-10-11 US disclosed
EP-3253390-B1 AMINOQUINAZOLINE COMPOUNDS AS A2A ANTAGONIST MERCK SHARP & DOHME (US) 2022-04-13 EP disclosed
EP-3820474-A1 ADENOSINE RECEPTOR BINDING COMPOUNDS Nikang Therapeutics, Inc. (US) 2021-05-19 EP disclosed
US-20210115054-A1 TRIAZOLO[4,5-D] PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS VERNALIS (R&D) LIMITED (GB) 2021-04-22 US disclosed
US-10875868-B2 Triazolo[4,5-d] pyramidine derivatives and their use as purine receptor antagonists VERNALIS (R&D) LIMITED (GB) 2020-12-29 US disclosed
US-20200172547-A1 TRIAZOLO[4,5-D] PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS VERNALIS (R&D) LIMITED (GB) 2020-06-04 US disclosed
US-10654825-B2 Processes for making triazolo[4,5D] pyramidine derivatives and intermediates thereof CORVUS PHARMACEUTICALS, INC. (US) 2020-05-19 US disclosed
US-10654825-B2 Processes for making triazolo[4,5D] pyramidine derivatives and intermediates thereof CORVUS PHARMACEUTICALS, INC. (US) 2020-05-19 US disclosed
EP-3600292-A1 PROCESSES FOR MAKING TRIAZOLO[4,5D]PYRAMIDINE DERIVATIVES AND INTERMEDIATES THEREOF Corvus Pharmaceuticals, Inc. (US) 2020-02-05 EP disclosed
WO-2016126570-A1 AMINOQUINAZOLINE COMPOUNDS AS A2A ANTAGONIST MERCK SHARP & DOHME CORP. (US) 2016-08-11 WO disclosed
US-9376443-B2 Triazolo[4,5-D] pyramidine derivatives and their use as purine receptor antagonists VERNALIS (R&D) LIMITED (GB) 2016-06-28 US disclosed
US-20150291602-A1 TRIAZOLO[4,5-D] PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS VERNALIS (R&D) LIMITED (GB) 2015-10-15 US disclosed
US-8987279-B2 Triazolo [4, 5-D] pyramidine derivatives and their use as purine receptor antagonists VERNALIS (R&D) LIMITED (GB) 2015-03-24 US disclosed
US-20130245044-A1 TRIAZOLO[4, 5-D] PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS VERNALIS RESEARCH LIMITED (GB) 2013-09-19 US disclosed
US-8450328-B2 Triazolo[4,5-D]pyramidine derivatives and their use as purine receptor antagonists VERNALIS (R&D) LIMITED (GB) 2013-05-28 US disclosed
EP-2321321-B1 TRIAZOLO [4, 5-D]PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS VERNALIS R&D LTD (GB) 2012-02-08 EP disclosed
US-20110172252-A1 TRIAZOLO[4,5-D]PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS VERNALIS RESEARCH LIMITED 2011-07-14 US disclosed
EP-2321321-A1 TRIAZOLO [4, 5-D]PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS Vernalis (R&D) Limited (GB) 2011-05-18 EP disclosed
WO-2009156737-A1 TRIAZOLO [4, 5-D] PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS VERNALIS (R&D) LIMITED (GB) 2009-12-30 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 (9 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-20110172252-A1 TRIAZOLO[4,5-D]PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS P2RX5, P2RY1, P2RX3 ADORA2A 11/4885ADORA3 14/4885ADORA2B 19/4885
US-10875868-B2 Triazolo[4,5-d] pyramidine derivatives and their use as purine receptor antagonists P2RX5, P2RY1, P2RX3 ADORA2A 11/4885ADORA3 14/4885ADORA2B 19/4885
US-20210115054-A1 TRIAZOLO[4,5-D] PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS P2RX5, P2RY1, P2RX3 ADORA2A 11/4885ADORA3 14/4885ADORA2B 19/4885
US-20150291602-A1 TRIAZOLO[4,5-D] PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS P2RX5, P2RY1, P2RX3 ADORA2A 11/4885ADORA3 14/4885ADORA2B 19/4885
US-20130245044-A1 TRIAZOLO[4, 5-D] PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS P2RX5, P2RY1, P2RX3 ADORA2A 11/4885ADORA3 14/4885ADORA2B 19/4885
US-11466019-B2 Triazolo[4,5-d] pyramidine derivatives and their use as purine receptor antagonists P2RX5, P2RY1, P2RX3 ADORA2A 11/4885ADORA3 14/4885ADORA2B 19/4885
US-20230100842-A1 TRIAZOLO[4,5-D] PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS P2RX5, P2RY1, P2RX3 ADORA2A 11/4885ADORA3 14/4885ADORA2B 19/4885
US-10654825-B2 Processes for making triazolo[4,5D] pyramidine derivatives and intermediates thereof IL5, THPO, PPOX ADORA2A 782/4885ADORA3 1229/4885ADORA2B 1112/4885
US-20200172547-A1 TRIAZOLO[4,5-D] PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS P2RX5, P2RY1, P2RX3 ADORA2A 11/4885ADORA3 14/4885ADORA2B 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.