SCHEMBL4594

SCHEMBL4594

[CH2]CCN1CCNCC1

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
SCHEMBL1098898 0.91 CXCR4 (0.63)
SCHEMBL1289987 0.84
SCHEMBL293768 0.84 CXCR4 (0.56)
SCHEMBL1282474 0.82 CXCR4 (0.57)
SCHEMBL237512 0.82 POLB (0.59)
SCHEMBL55508 0.80 CXCR4 (0.61)
SCHEMBL43582 0.79 CXCR4 (0.61)
SCHEMBL9317140 0.79 POLB (0.56)
Hydrochloric Acid SCHEMBL5572604 0.79 POLB (0.56)
SCHEMBL387453 0.78

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 1921 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024120454-A1 BIS-PHOSPHATIDYL AMINE COMPOUNDS CONTAINING MULTIPLE TERTIARY AMINO STRUCTURES, AND COMPOSITION AND USE THEREOF 北京大学 2024-06-13 WO claimed
CN-118146262-A Bi-phosphatidyl amide compound containing multiple tertiary amino structures, composition and application thereof 北京大学 2024-06-07 CN claimed
CN-116656240-B Photo-curing coating and coating prepared based on epoxy acrylate condensed alkenyl silicone resin 云南众合硅基新材料有限公司 2024-06-07 CN claimed
CN-116003801-B Three-fork crosslinking amino silicone oil and preparation method thereof 湖北兴瑞硅材料有限公司 2024-05-17 CN claimed
CN-114450284-B 6, 7-Dihydro-5H-pyrido [2,3-C ] pyridazine derivatives as BCL-XL protein inhibitors 法国施维雅药厂 2024-05-07 CN claimed
CN-116042091-B Preparation method of amino/phenyl fluorosilicone resin composite epoxy styrene-acrylic paint and coating 陕西科技大学 2024-04-26 CN claimed
CN-117903696-A Water-based modified fluorosilicone resin coating composition, coating and preparation method thereof 东莞市雄驰电子有限公司 2024-04-19 CN claimed
CN-117887077-A Water-repellent and oil-repellent fabric finishing agent, emulsion and preparation method thereof 山东东岳高分子材料有限公司 2024-04-16 CN claimed
EP-3750894-B1 UREA-SUBSTITUTED AROMATIC RING-LINKED DIOXAZOLINE COMPOUND, PREPARATION METHOD THEREFOR, AND USES THEREOF BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) 2024-04-03 EP claimed
EP-4003989-B1 6,7-DIHYDRO-5H-PYRIDO[2,3-C]PYRIDAZINE DERIVATIVES AND RELATED COMPOUNDS AS BCL-XL PROTEIN INHIBITORS AND PRO-APOPTOTIC AGENTS FOR TREATING CANCER SERVIER LAB (FR) 2023-12-27 EP claimed
WO-1997034876-A1 CINNOLINE DERIVATIVES AND USE AS MEDICINE ZENECA LIMITED (GB) 1997-09-25 WO claimed
WO-1997032856-A1 4-ANILINOQUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1997-09-12 WO claimed
WO-1997030035-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS ZENECA LIMITED (GB) 1997-08-21 WO claimed
US-5627197-A Adhesion receptor antagonists MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1997-05-06 US claimed
US-5516915-A Bis-(1H-indol-3-yl)-maleinimide derivatives, processes for the preparation thereof and pharmaceutical compositions containing them GOEDECKE AKTIENGESELLSCHAFT (DE) 1996-05-14 US claimed
EP-0251905-B1 Esters of alginic acid FIDIA SPA (IT) 1994-11-02 EP claimed
EP-0609968-A2 Compositions comprising partial esters of alginic acid FIDIA S.p.A. (IT) 1994-08-10 EP claimed
EP-0309765-A2 1(2H)-Phthalazinones as cytoprotective agents FISONS CORPORATION (US) 1989-04-05 EP claimed
EP-0251905-A2 Esters of alginic acid FIDIA S.p.A. (IT) 1988-01-07 EP claimed
US-4410536-A 7,8,9,10-Tetrahydrothieno[3,2-e]pyrido[4,3-b]indole compounds and their anti-depressant use TROPONWERKE GMBH & CO. K.G. (DE) 1983-10-18 US claimed