SCHEMBL94013

SCHEMBL94013

Nc1ccncn1

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
SCHEMBL29761092 1.00
Water SCHEMBL29999382 0.97
Hydrochloric Acid SCHEMBL4721943 0.97 HSP90AA1 (0.94)
Methane SCHEMBL28146623 0.97
Water SCHEMBL30678037 0.97 HSP90AA1 (0.94)
SCHEMBL29564027 0.97
Fluoride SCHEMBL27631921 0.97
Hydrochloric Acid SCHEMBL4719153 0.97
Hydrochloric Acid SCHEMBL21683007 0.97
Hydrochloric Acid SCHEMBL27436731 0.97

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 8648 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260109697-A1 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL)-PYRIMIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2026-04-23 US claimed
EP-4142732-B1 METHODS OF USE FOR PYRIMIDINES AS FERROPORTIN INHIBITORS GLOBAL BLOOD THERAPEUTICS INC (US) 2026-04-22 EP claimed
CN-120647626-B 4-Aminopyrimidine compound targeting EGFR and AXL targets as well as preparation method and application thereof 江西省肿瘤医院(江西省第二人民医院、江西省癌症中心) 2026-02-27 CN claimed
US-20250368635-A1 HETEROARYL DERIVATIVE COMPOUND, AND USES THEREOF VORONOI, INC. (KR) 2025-12-04 US claimed
EP-4585589-A2 STEM CELL CULTURES The Scripps Research Institute (US) 2025-07-16 EP claimed
EP-4580616-A1 SUSTAINED RELEASE DELIVERY OF A PDE10 INHIBITOR Merck Sharp & Dohme LLC (US) 2025-07-09 EP 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-119997954-A Compounds for the treatment of spinocerebellar ataxia type 3 PTC医疗公司 2025-05-13 CN claimed
EP-4232448-B1 AGONISTS OF FREE FATTY ACID RECEPTOR 1 AND THEIR USE IN DISEASES ASSOCIATED WITH SAID RECEPTOR Halo Therapeutics Ltd (GB) 2025-05-07 EP claimed
CN-119657051-A Temperature control method and reaction device of thermotropic liquid crystal polyester synthesis reaction kettle 浙江聚领新材料有限公司 2025-03-21 CN claimed
US-4767553-A POLYMER OF UNSATURATED ANHYDRIDE AND A (METH)ACRYLATE FUNCTIONALIZED WITH PHENOTHIAZINE AND A HETEROCYCLIC PRIMARY OR SECONDARY AMINE TEXACO INC. (US) 1988-08-30 US claimed
EP-0276406-A1 Substituted 4-amino-pyrimidines BAYER AG (DE) 1988-08-03 EP claimed
CN-86100279-A The method for preparing the Pyridopyrimidine compounds 1986-11-19 CN claimed
EP-0191443-A2 4-Amino-pyrimidines and fungicides containing them BASF Aktiengesellschaft (DE) 1986-08-20 EP claimed
EP-0189045-A2 Pyridopyrimidines, different processes for their preparation as well as their use as medicaments BAYER AG (DE) 1986-07-30 EP claimed
US-4594413-A Preparation of N,N'-methylene-2,2'-azopyridocyanines THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1986-06-10 US claimed
EP-0091652-B1 ERGOLINE DERIVATIVES, PROCESS FOR PRODUCING THE ERGOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FARMITALIA CARLO ERBA S.p.A. (IT) 1986-02-26 EP claimed
EP-0091652-A1 Ergoline derivatives, process for producing the ergoline derivatives and pharmaceutical compositions containing them FARMITALIA CARLO ERBA S.p.A. (IT) 1983-10-19 EP claimed
EP-0004320-B1 1-SUBSTITUTED-THIOMETHYLTRIAZOLOBENZODIAZEPINES, PREPARATION THEREOF, THEIR USE, AND A PHARMACEUTICAL COMPOSITION SHIONOGI & CO., LTD. (JP) 1981-12-16 EP claimed
US-4038278-A ANTIINFLAMMATORY, ANALGESICS - NO GASTROINTESTINAL TROUBLE EISAI CO., LTD. (JA) 1977-07-26 US claimed