SCHEMBL2031613

SCHEMBL2031613

Nc1cc(N)c(N)cn1

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
SCHEMBL29557324 1.00
SCHEMBL11579685 0.75 PTK2 (0.41)
SCHEMBL20429885 0.75
SCHEMBL3364318 0.75
SCHEMBL13351204 0.75
SCHEMBL14293400 0.75
SCHEMBL13893598 0.75
SCHEMBL13016652 0.75
Hydrochloric Acid SCHEMBL7174430 0.73 NOS3 (0.41)
SCHEMBL191846 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117757247-A Linear phosphonamide oligomer flame retardant synergistic flame retardant thermoplastic polyurethane elastomer composite material and preparation method thereof 北京工商大学 2024-03-26 CN claimed
CN-117757084-A Linear phosphonamide oligomer flame retardant, preparation method thereof and application thereof in thermoplastic polyurethane elastomer 北京工商大学 2024-03-26 CN claimed
CN-117399068-A Preparation method of COD reagent 九江德福科技股份有限公司 2024-01-16 CN claimed
CN-117304445-A Room-temperature self-repairing flexible ablation-resistant material and preparation method and application thereof 四川大学 2023-12-29 CN claimed
CN-115028771-B Method for preparing dendritic amphiphilic acrylamide copolymer by suspension polymerization method and application thereof 安徽天润化学工业股份有限公司 2023-09-26 CN claimed
CN-116239790-A Carboxyl end-capped hyperbranched polyamide based on furandicarboxylic acid, preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2023-06-09 CN claimed
CN-113089317-B Aminopyridine modified biomass fiber surface imprinting adsorption material and preparation method thereof 武汉纺织大学 2022-09-30 CN claimed
CN-115028771-A Method for preparing dendritic amphiphilic acrylamide copolymer by suspension polymerization method and application thereof 安徽天润化学工业股份有限公司 2022-09-09 CN claimed
CN-114369222-A High-strength room-temperature rapid self-repairing flexible material and preparation method and application thereof 四川大学 2022-04-19 CN claimed
CN-113089317-A Aminopyridine modified biomass fiber surface imprinting adsorption material and preparation method thereof 武汉纺织大学 2021-07-09 CN claimed
EP-1432388-A1 AGENT FOR COLOURING FIBRES CONTAINING KERATIN Henkel Kommanditgesellschaft auf Aktien (DE) 2004-06-30 EP claimed
EP-1433469-A1 Composition for dyeing keratinous fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2004-06-30 EP claimed
EP-1433785-A1 Agents for the coloration of keratinous fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2004-06-30 EP claimed
EP-1362579-A1 Agent for dyeing keratinous fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2003-11-19 EP claimed
WO-2003030849-A1 METHOD FOR DYEING AND SUBSEQUENT BLEACHING OF HAIR HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-04-17 WO claimed
WO-2003030841-A1 METHOD FOR DYEING KERATINOUS FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-04-17 WO claimed
WO-2003030847-A1 AGENT FOR COLOURING FIBRES CONTAINING KERATIN HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-04-17 WO claimed
EP-1300135-A1 Agent for dyeing keratinous fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2003-04-09 EP claimed
EP-1300134-A2 Agent for dyeing keratinous fibres with isophthalaldehydes Henkel Kommanditgesellschaft auf Aktien (DE) 2003-04-09 EP claimed
EP-1300132-A2 Agent for dyeing keratinous fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2003-04-09 EP claimed