SCHEMBL1269042

SCHEMBL1269042

CC(C)(C)C=NO

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
SCHEMBL4851111 1.00
SCHEMBL5836623 1.00
Methane SCHEMBL8093397 0.96
Carbamic Acid SCHEMBL11289777 0.83 ACHE (0.37)
Carbamic Acid SCHEMBL11289771 0.83 ACHE (0.37)
SCHEMBL10934768 0.79 POLB (0.35)
SCHEMBL22450947 0.77 ALDH1A1 (0.43)
SCHEMBL11373067 0.74
SCHEMBL11373069 0.74
SCHEMBL23248644 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013050579-A1 CONTROLLED-HEALING POLYSILOXANES, PROCESS FOR THEIR PREPARATION AND USE OF SAID POLYSILOXANES DELPHI CONNECTION SYSTEMS HOLDING FRANCE (FR) 2013-04-11 WO claimed
US-5268417-A Free radical polymerization of an aldehyde or ketone with an oxime-blocked polyisocyanate BASF AKTIENGESELLSCHAFT (DE) 1993-12-07 US claimed
US-20250257056-A1 ALPHA-D-GALACTOPYRANOSIDE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2025-08-14 US disclosed
US-12319672-B2 Alpha-D-galactopyranoside derivatives IDORSIA PHARMACEUTICALS LTD (CH) 2025-06-03 US disclosed
US-20240158384-A1 CB2 RECEPTOR AGONISTS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2024-05-16 US disclosed
CN-117616881-A Electronic device and method for manufacturing electronic device 富士胶片株式会社 2024-02-27 CN disclosed
CN-117580889-A Curing agent for epoxy resins SIKA技术股份公司 2024-02-20 CN disclosed
EP-4021904-B1 ALPHA-D-GALACTOPYRANOSIDE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2024-01-03 EP disclosed
CN-116283815-B Preparation method of 1, 3-benzoxazine compound 嘉实(湖南)医药科技有限公司 2023-08-08 CN disclosed
CN-116283815-A Preparation method of 1, 3-benzoxazine compound 嘉实(湖南)医药科技有限公司 2023-06-23 CN disclosed
US-20220281855-A1 ALPHA-D-GALACTOPYRANOSIDE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2022-09-08 US disclosed
US-4495369-A REACTION OF NEOPENTANOL AND AMMONIA USING A HYDROGENATION CATALYST BAYER AKTIENGESELLSCHAFT (DE) 1985-01-22 US disclosed
EP-0093332-A1 Method for the preparation of 2,2-dimethyl-propane nitrile BAYER AG (DE) 1983-11-09 EP disclosed
EP-0022532-B1 PROCESS FOR THE PREPARATION OF NEOPENTYLAMINE BAYER AG (DE) 1983-02-16 EP disclosed
EP-0002480-B1 PROCESS FOR PREPARATION OF 1,2-OXAZOLE DERIVATIVES BASF Aktiengesellschaft (DE) 1982-06-09 EP disclosed
US-4268674-A OXIME, AZODICARBOXYLATE, HYPOHALITE THE DOW CHEMICAL COMPANY (US) 1981-05-19 US disclosed
US-4259235-A REDUCTION OF PLANT GROWTH HEIGHT BASF AKTIENGESELLSCHAFT (DE) 1981-03-31 US disclosed
EP-0022532-A1 Process for the preparation of neopentylamine BAYER AG (DE) 1981-01-21 EP disclosed
EP-0002881-A1 5-Isoxazolylurea derivatives, their preparation, their use and compositions containing them FISONS plc (GB) 1979-07-11 EP disclosed
EP-0002480-A1 Process for preparation of 1,2-oxazole derivatives BASF Aktiengesellschaft (DE) 1979-06-27 EP disclosed