SCHEMBL87629

SCHEMBL87629

O=Cc1ncco1

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
SCHEMBL27822047 0.97
Thiophene SCHEMBL28193265 0.85 CYP2A6 (0.33)
Quinoline SCHEMBL27893420 0.78 ALDH1A1 (0.55)
SCHEMBL15870902 0.78
SCHEMBL7704419 0.78
SCHEMBL12240205 0.77
Methylpyrrolidone SCHEMBL28258332 0.75 BRD4 (0.50)
SCHEMBL2851437 0.74
SCHEMBL3100807 0.74
SCHEMBL39636 0.74

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 1961 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118791322-B Carbon nanowire/porous glass carbon composite material and preparation method thereof 湖南德智新材料有限公司 2024-11-15 CN claimed
CN-118791322-A Carbon nanowire/porous glass carbon composite material and preparation method thereof 湖南德智新材料有限公司 2024-10-18 CN claimed
CN-118159542-A Substituted 2, 3-dihydro [1,3] thiazolo [4,5-b ] pyridines, salts thereof and their use as herbicidal agents 拜耳公司 2024-06-07 CN claimed
CN-115819366-B Preparation method of 2-aroyl substituted oxazole compound and compound prepared by same 重庆医科大学 2024-05-24 CN claimed
CN-117451624-A Multi-mode combined nano probe for simultaneously detecting multiple bacteria and preparation method thereof 江西师范大学 2024-01-26 CN claimed
CN-113999186-B C5 arylformyl oxazole compound and preparation method thereof 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) 2023-11-14 CN claimed
CN-115819366-A Preparation method of 2-aroyl substituted oxazole compound and compound prepared by same 重庆医科大学 2023-03-21 CN claimed
CN-109810110-B Compound with 2-aminopyrimidine structure, preparation method and application thereof 中国科学院上海药物研究所 2023-01-24 CN claimed
EP-3331959-B1 ANIONIC CURABLE COMPOSITIONS DESIGNER MOLECULES INC (US) 2022-10-05 EP claimed
US-20220204696-A1 PHENOLIC FUNCTIONALIZED POLYIMIDES AND COMPOSITIONS THEREOF DESIGNER MOLECULES, INC 2022-06-30 US claimed
US-6294536-B1 CONTROL OF PROTOZOA AND REDUCTION IN THE INCIDENCE OF ASSOCIATED DISEASES AND DEATH AND CONSEQUENT IMPROVEMENT IN RETARDED GROWTH AND GENERAL CONDITION AND PREVENTING DECREASE GROWTH AND GENERAL CONDITION TAKEDA SCHERING-PLOUGH ANIMAL HEALTH K.K. (JP) 2001-09-25 US claimed
CN-1199613-A Preparation having increased in vivo tolerability HOECHST AG (DE) 1998-11-25 CN claimed
CN-1195341-A Substituted 1-amino-3-phenyluracil derivatives, their preparation and their use as herbicides BAYER AG (DE) 1998-10-07 CN claimed
EP-0851861-A1 SUBSTITUTED 1-AMINO-3-PHENYLURACIL DERIVATIVES, THEIR PREPARATION AND THEIR USE AS HERBICIDES BAYER AG (DE) 1998-07-08 EP claimed
CN-1185156-A Novel substituted tetrahydropyrano [3, 2-d ] oxazolones, process for their preparation and pharmaceutical compositions containing them ADIR ET CO (FR) 1998-06-17 CN claimed
CN-1036394-C Process for preparing quinolone derivatives OTSUKA PHARMA CO LTD (JP) 1997-11-12 CN claimed
WO-1997009319-A1 SUBSTITUTED 1-AMINO-3-PHENYLURACIL DERIVATIVES, THEIR PREPARATION AND THEIR USE AS HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-03-13 WO claimed
US-4582903-A Synthesis of unsaturated hydantoins with an inexpensive catalyst STAUFFER CHEMICAL COMPANY (US) 1986-04-15 US claimed
EP-0059146-B1 MEDICAMENTS DERIVED FROM 3-HYDROXY DODECAHYDRO BENZ(E) INDEN-7-ON, PRODUCTS DERIVED FROM 3-HYDROXY DODECAHYDRO BENZ(E) INDEN-7-ON AND PROCESS FOR THEIR PREPARATION ROUSSEL-UCLAF (FR) 1985-09-25 EP claimed
US-4472386-A 5-Fluoro-(β-uridine or 2'-deoxy-β-uridine) derivatives, a process for producing the same and a carcinostatic agent containing the same TOYAMA CHEMICAL CO., LTD. (JP) 1984-09-18 US claimed