SCHEMBL420023

SCHEMBL420023

COC(=O)c1cn[nH]c1

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
Water SCHEMBL11246942 0.98 ALDH1A1 (0.44)
Trimethylammonium SCHEMBL28058888 0.94 ALDH1A1 (0.42)
Isopropyl Alcohol SCHEMBL7083853 0.92 ROCK2 (0.41)
Ether SCHEMBL11246939 0.89 BAZ2B (0.41)
Biphenyl SCHEMBL27886012 0.88 TSHR (0.53)
SCHEMBL31258555 0.86
SCHEMBL930017 0.82 ALDH1A1 (0.42)
SCHEMBL20029177 0.79 ACACB (0.39)
SCHEMBL872179 0.78
SCHEMBL19100007 0.78 CA12 (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116801720-A Novel agrochemical compositions comprising 3-substituted benzamidine compounds and uses thereof 皮埃企业有限公司 2023-09-22 CN claimed
CN-116234444-A Mixtures with insecticidal activity comprising sulfur-containing heterocyclylalkoxy compounds, oxides or salts thereof 皮埃企业有限公司 2023-06-06 CN claimed
WO-2023277517-A1 ACYCLIC NUCLEIC ACID MIMIC COMPRISING PENTACYCLIC BASE 동아대학교 산학협력단 2023-01-05 WO claimed
CN-109362744-A A kind of herbicidal composition containing metamifop and dichloro quinolinic acid 安徽圣丰生化有限公司 2019-02-22 CN claimed
CN-109287638-A A kind of rice weeding composition containing metamifop 安徽圣丰生化有限公司 2019-02-01 CN claimed
CN-109287647-A A kind of herbicide and preparation method thereof containing halosulfuronmethyl 安徽圣丰生化有限公司 2019-02-01 CN claimed
CN-106946890-A Pyridines IRAK4 inhibitor, its preparation method and application 中国药科大学 2017-07-14 CN claimed
CN-101827847-A Purine derivatives as adenosine al receptor ligands NOVARTIS AG 2010-09-08 CN claimed
EP-1337508-A1 PREPARATION OF SODIUM-HYDROGEN EXCHANGER TYPE-1 INHIBITORS Pfizer Products Inc. (US) 2003-08-27 EP claimed
WO-2002044133-A1 PREPARATION OF SODIUM-HYDROGEN EXCHANGER TYPE-1 INHIBITORS PFIZER PRODUCTS INC. (US) 2002-06-06 WO claimed
EP-3364967-B1 FERROPORTIN INHIBITORS VIFOR INT AG (CH) 2026-05-20 EP disclosed
EP-4737450-A1 HETEROAROMATIC FORMAMIDE COMPOUNDS AND USES THEREOF IN MEDICINE Longwood Pharmaceuticals (Hangzhou) Co., Ltd (CN) 2026-05-06 EP disclosed
EP-4737449-A1 P53-Y220C SELECTIVE SMALL-MOLECULAR REACTIVATOR COMPOUND, PHARMACEUTICAL COMPOSITION AND USE THEREOF Changchun Genescience Pharmaceutical Co., Ltd. (CN) 2026-05-06 EP disclosed
US-20260116881-A1 KIF MODULATOR COMPOUNDS AND METHODS OF USE IAMBIC THERAPEUTICS INC (US) 2026-04-30 US disclosed
EP-4178620-B1 PLASMA KALLIKREIN INHIBITORS MERCK SHARP & DOHME LLC (US) 2026-04-01 EP disclosed
US-5066479-A Useful For Radioimmunodetection And Radiotherapy Of Diseases Such As Cancer THE REGENTS OF THE UNIV. OF CALIFORNIA (US) 1991-11-19 US disclosed
EP-0208281-B1 QUINOLINE 8-CARBOXYLIC-ACID AZOLIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES BASF Aktiengesellschaft (DE) 1991-01-30 EP disclosed
US-4832731-A Quinoline-8-carboxylic acid azolides and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 1989-05-23 US disclosed
EP-0208281-A2 Quinoline 8-carboxylic-acid azolides, process for their preparation and their use as herbicides BASF Aktiengesellschaft (DE) 1987-01-14 EP disclosed
CN-86100911-A The preparation method of pyrazoles sulfone amide derivative and the weedicide that contains this kind derivative 1986-09-24 CN disclosed