SCHEMBL24031895

SCHEMBL24031895

C=C(CC(C)(C)C)C1=NCCO1

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
SCHEMBL212053 0.78 HDAC3 (0.39)
SCHEMBL9281844 0.72
SCHEMBL11785635 0.71 ADRA2A (0.32)
Hydrochloric Acid SCHEMBL8535633 0.70
SCHEMBL27760002 0.68
SCHEMBL28883338 0.67 HDAC3 (0.33)
SCHEMBL9669159 0.66
SCHEMBL14572844 0.65 HDAC3 (0.32)
SCHEMBL11126927 0.64 HDAC3 (0.32)
Allylamine SCHEMBL28106768 0.64 ALDH1A1 (0.31)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4306133-A1 COMPOSITION FOR ADMINISTRATION OF DOUBLE-STRANDED OLIGONUCLEOTIDE STRUCTURES USING ULTRASONIC NEBULIZER FOR PREVENTION OR TREATMENT OF RESPIRATORY VIRAL INFECTION INCLUDING COVID-19, PULMONARY FIBROSIS CAUSED BY VIRAL INFECTION, OR RESPIRATORY DISEASES Bioneer Corporation (KR) 2024-01-17 EP disclosed
WO-2021229479-A1 COMPOSITION FOR PREVENTING OR TREATING OBESITY-RELATED DISEASE CONTAINING AMPHIREGULIN-SPECIFIC DOUBLE-STRANDED OLIGONUCLEOTIDE STRUCTURE (주)바이오니아 2021-11-18 WO disclosed