SCHEMBL117462

SCHEMBL117462

[CH2]CC(OC)OC

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
Magnesium Chloride Anhydrous SCHEMBL28927199 0.87
Zinc Chloride SCHEMBL28962142 0.87
SCHEMBL3563787 0.78
SCHEMBL7764503 0.74
SCHEMBL10431809 0.73
SCHEMBL10437243 0.72
SCHEMBL411455 0.72
SCHEMBL2415617 0.69
SCHEMBL1963969 0.67
SCHEMBL3731262 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 431 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024115403-A1 NICOTINE-BASED IONIC LIQUIDS FOR WATER VAPOR REMOVAL FOUNDATION OF RESEARCH AND TECHNOLOGY HELLAS / INSTITUTE OF CHEMICAL ENGINEERING SCIENCES (GR) 2024-06-06 WO claimed
EP-3766882-B1 PHTHALAZINE ISOXAZOLE ALKOXY DERIVATIVES, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION AND USE THEREOF SHANGHAI SIMR BIOTECHNOLOGY CO LTD (CN) 2023-08-23 EP claimed
CN-110256440-B Phthalazine isoxazole alkoxy derivative, preparation method, pharmaceutical composition and application thereof 上海赛默罗生物科技有限公司 2023-05-23 CN claimed
US-20230133203-A1 Substituted Pyrazolo-Pyrimidines and Uses Thereof Verge Analytics, Inc. (US) 2023-05-04 US claimed
CN-116041789-A Organic silicon resin modified silicon dioxide nano particle and preparation method and application thereof 华南理工大学 2023-05-02 CN claimed
WO-2022261069-A1 METHODS AND TREATMENT OF VIRAL INFECTION WITH SUBSTITUTED PYRAZOLO-PYRIMIDINES Verge Analytics, Inc. (US) 2022-12-15 WO claimed
WO-2022256299-A1 7-MORPHOLINO-5-(3-PHENYL-1 H-PYRAZOL-1 -YL)-FURO[3,2-B]PYRIDINE DERIVATIVES AND SIMILAR COMPOUNDS AS PIKFYVE KINASE INHIBITORS FOR THE TREATMENT OF E.G. AMYOTROPHIC LATERAL SCLEROSIS (ALS) Verge Analytics, Inc. (US) 2022-12-08 WO claimed
WO-2022256298-A1 7-(3-PHENYL-1 H-PYRAZOL-1-YL)-5-MORPHOLINO-IMIDAZO[1,2-A]PYRIMIDINE DERIVATIVES AND SIMILAR COMPOUNDS AS PIKFYVE KINASE INHIBITORS FOR THE TREATMENT OF E.G. AMYOTROPHIC LATERAL SCLEROSIS (ALS) Verge Analytics, Inc. (US) 2022-12-08 WO claimed
WO-2022256297-A1 2-(3-PHENYL-1H-PYRAZOL-1-YL)-4-MORPHOLINO-5H-PYRROLO[3,2-D]PYRIMIDINE DERIVATIVES AND SIMILAR COMPOUNDS AS PIKFYVE KINASE INHIBITORS FOR THE TREATMENT OF E.G. AMYOTROPHIC LATERAL SCLEROSIS (ALS) Verge Analytics, Inc. (US) 2022-12-08 WO claimed
CN-115209952-A Substituted pyrazolopyrimidines and use thereof 维基分析有限公司 2022-10-18 CN claimed
EP-0278311-B1 2-AMINOMETHYL TETRAHYDROFURANES BAYER AG (DE) 1990-07-18 EP claimed
EP-0359979-A1 Aminomethylheterocyclic compounds, process for their preparation, their use in pesticides, and intermediates BAYER AG (DE) 1990-03-28 EP claimed
EP-0355597-A1 Substituted dioxolanylethylamines, process for their preparation, their use in pesticides, and intermediates BAYER AG (DE) 1990-02-28 EP claimed
EP-0355544-A2 Substituted decalin amines, method for their preparation and their use in pesticides BAYER AG (DE) 1990-02-28 EP claimed
US-4851405-A FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1989-07-25 US claimed
US-4800202-A FUNGICIDES, PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1989-01-24 US claimed
EP-0289913-A2 Parasiticidal agent based on substituted aminomethyl heterocycles BAYER AG (DE) 1988-11-09 EP claimed
EP-0281842-A1 Aminomethyl-heterocycles BAYER AG (DE) 1988-09-14 EP claimed
EP-0278352-A2 Aminomethyl-tetrahydro-furanes BAYER AG (DE) 1988-08-17 EP claimed
EP-0278311-A1 2-Aminomethyl tetrahydrofuranes BAYER AG (DE) 1988-08-17 EP claimed