SCHEMBL536688

SCHEMBL536688

CC(C)(O)c1cccc(CO)n1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 18/20 0.42
HCRTR2 O43614 18/20 0.42
CCR1 P32246 1/20 0.39
ADORA2A P29274 1/20 0.38

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
SCHEMBL30382126 1.00 HCRTR1 (0.42) HCRTR1HCRTR2CCR1ADORA2A
SCHEMBL22251076 0.86 HCRTR1 (0.47) HCRTR1HCRTR2
SCHEMBL2440105 0.86 CCR1 (0.40) HCRTR1HCRTR2CCR1
SCHEMBL29994822 0.85 HCRTR1 (0.40) HCRTR1HCRTR2ADORA2A
SCHEMBL13104652 0.84 HCRTR1 (0.45) HCRTR1HCRTR2
SCHEMBL24914919 0.83 CCR1 (0.35) HCRTR1HCRTR2CCR1
SCHEMBL7803702 0.82 CCR1 (0.38) HCRTR1HCRTR2CCR1
SCHEMBL130926 0.82 HCRTR1 (0.41) HCRTR1HCRTR2ADORA2A
SCHEMBL20910195 0.82 HCRTR1 (0.41) HCRTR1HCRTR2ADORA2A
SCHEMBL536812 0.82 HCRTR1 (0.41) HCRTR1HCRTR2ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12195447-B2 Azolopyrimidine for the treatment of cancer-related disorders ARCUS BIOSCIENCES, INC. (US) 2025-01-14 US disclosed
US-20240376081-A1 POLYMORPH AND APPLICATION OF PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF YANGTZE RIVER PHARMACEUTICAL GROUP CO., LTD. (CN) 2024-11-14 US disclosed
CN-116981669-B Pyrimidine or pyrido heterocyclic adenosine receptor inhibitor, preparation method and application thereof 上海齐鲁制药研究中心有限公司 2024-08-30 CN disclosed
EP-4403553-A1 POLYMORPH AND APPLICATION OF PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Shanghai Haiyan Pharmaceutical Technology Co., Ltd. (CN) 2024-07-24 EP disclosed
CN-118373808-A Substituted pyrimidine or pyridine amine derivatives, compositions thereof and pharmaceutical use thereof 上海海雁医药科技有限公司 2024-07-23 CN disclosed
CN-113015523-B Solid forms of azopyrimidine compounds 艾库斯生物科学有限公司 2024-07-16 CN disclosed
US-11993584-B2 Solid forms of an azolopyrimidine compound ARCUS BIOSCIENCES, INC. (US) 2024-05-28 US disclosed
CN-113748110-B Substituted pyrimidine or pyridine amine derivatives, compositions thereof and pharmaceutical use thereof 上海海雁医药科技有限公司 2024-05-14 CN disclosed
CN-117794913-A Polymorphs of pyrimidine derivatives and pharmaceutically acceptable salts thereof and uses thereof 上海海雁医药科技有限公司 2024-03-29 CN disclosed
EP-4310082-A2 AZOLOPYRIMIDINE FOR THE TREATMENT OF CANCER-RELATED DISORDERS Arcus Biosciences, Inc. (US) 2024-01-24 EP disclosed
CN-102076692-B Triazolo [4,5-D ] pyrimidine derivatives and their use as purine receptor antagonists VERNALIS RESEARCH LTD. (GB) 2014-10-22 CN 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
CN-102076692-A Triazolo [4,5-D ] pyrimidine derivatives and their use as purine receptor antagonists VERNALIS R&D LTD 2011-05-25 CN 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
US-5280096-A Optically active polymer UNIVERSITY OF NEW MEXICO (US) 1994-01-18 US disclosed
US-5166062-A Reaction a mixture of acyl esters with enzymes and selectively deacylating followed by separation UNIVERSITY OF NEW MEXICO (US) 1992-11-24 US 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 (5 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 HCRTR1 816/4885HCRTR2 1055/4885CCR1 1357/4885
US-11993584-B2 Solid forms of an azolopyrimidine compound DPYD, CDK4, TPMT HCRTR1 4598/4885HCRTR2 4327/4885CCR1 2587/4885
US-12195447-B2 Azolopyrimidine for the treatment of cancer-related disorders ADORA2A, ADORA2B, ADORA1 HCRTR1 1835/4885HCRTR2 1345/4885CCR1 447/4885
US-20130245044-A1 TRIAZOLO[4, 5-D] PYRAMIDINE DERIVATIVES AND THEIR USE AS PURINE RECEPTOR ANTAGONISTS P2RX5, P2RY1, P2RX3 HCRTR1 816/4885HCRTR2 1055/4885CCR1 1357/4885
US-20240376081-A1 POLYMORPH AND APPLICATION OF PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ADORA2B, ADORA2A, ADORA3 HCRTR1 1827/4885HCRTR2 1265/4885CCR1 3028/4885

“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.