SCHEMBL97781

SCHEMBL97781

Nc1cncnc1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Hydrochloric Acid SCHEMBL28125542 0.96
Hydrochloric Acid SCHEMBL6903913 0.96
Hydrochloric Acid SCHEMBL28134983 0.93
SCHEMBL27846683 0.90 EGFR (0.33)
Pyridine SCHEMBL27585289 0.83 TSHR (0.47)
Imidazole SCHEMBL1672110 0.75 ALDH1A1 (0.56)
SCHEMBL28185850 0.75 HRH4 (0.40)
SCHEMBL20839255 0.74 KDM4E (0.43)
SCHEMBL18745784 0.74 DYRK1B (0.44)
SCHEMBL31609424 0.72

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

Appears in 2817 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120040759-A Hydrophilic metal chelate resin and preparation method and application thereof 浙江奥首材料科技有限公司 2025-05-27 CN claimed
CN-119075702-B Pollution-resistant seawater desalination membrane and preparation method thereof 湖南澳维科技股份有限公司 2025-05-16 CN claimed
CN-119979129-A Cooling liquid, preparation method thereof, battery and power utilization device 宁德时代新能源科技股份有限公司 2025-05-13 CN claimed
CN-119060459-B Preparation process of tear-resistant high-temperature-resistant ethylene propylene diene monomer 株洲泰信电子科技有限公司 2025-04-18 CN claimed
CN-119529376-A Modified resin and preparation method and application thereof 万华化学(宁波)有限公司 2025-02-28 CN claimed
EP-3848035-B1 1,4-DISUBSTITUTED PYRIDAZINE COMPOUNDS FOR TREATING HUNTINGTON'S DISEASE PTC THERAPEUTICS INC (US) 2025-02-19 EP claimed
CN-119345927-A Polyamide composite semipermeable membrane and preparation method and application thereof 万华化学集团股份有限公司 2025-01-24 CN claimed
CN-119075702-A Pollution-resistant seawater desalination membrane and preparation method thereof 湖南澳维科技股份有限公司 2024-12-06 CN claimed
CN-119060459-A Preparation process of tear-resistant high-temperature-resistant ethylene propylene diene monomer 株洲泰信电子科技有限公司 2024-12-03 CN claimed
CN-118076610-A Macrocyclic compounds with ENT1 inhibitory activity ITEOS比利时公司 2024-05-24 CN claimed
CN-1592624-A Substituted-triazolopyrimidines as anticancer agents WYETH CORP (US) 2005-03-09 CN claimed
JP-2004517862-A 2004-06-17 JP claimed
CN-1496262-A Triazolo [4, 5-d ] pyrimidine derivatives and their use as purinergic receptor antagonists О 2004-05-12 CN claimed
EP-1392312-A1 TRIAZOLO 4,5-d] PYRIMIDINE DERIVATIVES AND THEIR USE AS PURINERGIC RECEPTOR ANTAGONISTS VERNALIS RESEARCH LIMITED (GB) 2004-03-03 EP claimed
WO-2002055083-A1 TRIAZOLO[4,5-d] PYRIMIDINE DERIVATIVES AND THEIR USE AS PURINERGIC RECEPTOR ANTAGONISTS VERNALIS RESEARCH LIMITED (GB) 2002-07-18 WO claimed
EP-0561175-A1 Pyrimidine derivatives and pharmaceutical compostions containing them MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1993-09-22 EP claimed
EP-0245687-B1 SUBSTITUTED PYRIMIDINE AMIDES OF OLEIC OR LINOLEIC ACID AS INHIBITORS OF ACYL-COA CHOLESTEROL ACYLTRANSFERASE WARNER-LAMBERT COMPANY (US) 1991-02-27 EP claimed
EP-0245687-A1 Substituted pyrimidine amides of oleic or linoleic acid as inhibitors of acyl-coa cholesterol acyltransferase WARNER-LAMBERT COMPANY (US) 1987-11-19 EP claimed
EP-0175652-A2 5-Acylaminopyrimidines CIBA-GEIGY AG (CH) 1986-03-26 EP claimed
EP-0139477-A2 Process for preparing 5-substituted pyrimidines ELI LILLY AND COMPANY (US) 1985-05-02 EP claimed