SCHEMBL119321

SCHEMBL119321

CCOC=N

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
SCHEMBL8797086 1.00
Hydrochloric Acid SCHEMBL307783 0.96
SCHEMBL28291982 0.83
SCHEMBL3287132 0.72
SCHEMBL27263729 0.72
SCHEMBL8797088 0.69
SCHEMBL47728 0.69
SCHEMBL27527949 0.67
SCHEMBL3280767 0.67
SCHEMBL1407387 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220235058-A1 PROCESSES AND INTERMEDIATES FOR PREPARING A BTK INHIBITOR STA PHARMACEUTICAL HONG KONG LIMITED (CN) 2022-07-28 US claimed
EP-2970291-B1 PROCESSES AND INTERMEDIATES FOR PREPARING A MEDICAMENT JANSSEN PHARMACEUTICA NV (BE) 2022-05-11 EP claimed
CN-109761874-A Preparation process of medical intermediate 4-nitroindole 代可昕 2019-05-17 CN claimed
CN-105622483-B A kind of synthetic method of 4- nitroindoline 苏州艾缇克药物化学有限公司 2019-04-26 CN claimed
CN-109053534-A A kind of preparation method of medicine intermediate 4- nitroindoline 苏州盖德精细材料有限公司 2018-12-21 CN claimed
CN-105622483-A Synthesis method of 4-nitroindole ITIC MEDCHEM CO LTD 2016-06-01 CN claimed
CN-103351326-A Synthesis process of important pharmaceutical chemical intermediate 4-nitroindole ZHANGJIAGANG WEISHENG BIOLOG PHARCEUTICAL CO LTD 2013-10-16 CN claimed
EP-0792883-B1 Novel derivates of boronic acid, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2000-12-20 EP claimed
EP-0537543-A1 2-(2-(fluorophenyl)-1,3,4-thiadiazol-5-yl-oxy)-acetamides useful as herbicides BAYER AG (DE) 1993-04-21 EP claimed
EP-0516156-A1 Chemical modification of 2\"-amino group in elsamicin A Bristol-Myers Squibb Company (US) 1992-12-02 EP claimed
US-4957935-A Phenyltriazole derivative and insecticide KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1990-09-18 US claimed
US-4925935-A BACTERICIDES LEDERLE (JAPAN), LTD. (JP) 1990-05-15 US claimed
US-4866171-A THIENAMYCIN ANTIBIOTIC LEDERLE (JAPAN), LTD. (JP) 1989-09-12 US claimed
US-20240066047-A1 ANTIBODY-DRUG CONJUGATES COMPRISING A CYCLIC DINUCLEOTIDE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-02-29 US disclosed
US-11666594-B2 Antibody-drug conjugates comprising a cyclic dinucleotide TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-06-06 US disclosed
CN-111511737-B Monocyclic beta-lactam compounds for the treatment of bacterial infections 南京明德新药研发有限公司 2022-10-18 CN disclosed
US-4288450-A ANTIALLERGENS CIBA-GEIGY CORPORATION (US) 1981-09-08 US disclosed
US-4232030-A ANTIBIOTICS MERCK & CO., INC. (US) 1980-11-04 US disclosed
US-4194047-A Substituted N-methylene derivatives of thienamycin MERCK & CO., INC. (US) 1980-03-18 US disclosed
EP-0001264-A1 Substituted N-methylene derivatives of thienamycin sulfoxide and sulfone and their preparation MERCK & CO. INC. (US) 1979-04-04 EP disclosed