SCHEMBL1822293

SCHEMBL1822293

CC(C)=CC[NH2+][O-]

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
SCHEMBL13389631 0.71
SCHEMBL27096719 0.63 KMT2A (0.31)
SCHEMBL1276454 0.62 KMT2A (0.65)
SCHEMBL1305942 0.62
SCHEMBL1162771 0.61
SCHEMBL27096626 0.60 KMT2A (0.33)
SCHEMBL115620 0.60
SCHEMBL8813968 0.60 KMT2A (0.55)
SCHEMBL403101 0.60
SCHEMBL6064424 0.60

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8419948-B2 Wastewater treatment UNITED LABORATORIES INTERNATIONAL, LLC (US) 2013-04-16 US claimed
US-20110120958-A1 Wastewater Treatment UNITED LABORATORIES INTERNATIONAL, LLC (US) 2011-05-26 US claimed
US-4584070-A Process for preparing para-aminophenol PPG INDUSTRIES, INC. (US) 1986-04-22 US claimed
EP-0055924-B1 IMPROVED PROCESS FOR THE SELECTIVE PREPARATION OF P-AMINOPHENOL FROM NITROBENZENE MALLINCKRODT, INC.(a Missouri corporation) (US) 1984-10-03 EP claimed
EP-0055924-A1 Improved process for the selective preparation of p-aminophenol from nitrobenzene MALLINCKRODT, INC.(a Missouri corporation) (US) 1982-07-14 EP claimed
US-4307249-A DIMETHYLALKYLAMINE OXIDE SURFACTANT MALLINCKRODT, INC. (US) 1981-12-22 US claimed
JP-3079694-A None JP disclosed
JP-5019217-A None JP disclosed
JP-1139518-A None JP disclosed
JP-9328312-A None JP disclosed
JP-4074110-A None JP disclosed
US-11788192-B2 Inhibitors of metal corrosion ARKEMA FRANCE (FR) 2023-10-17 US disclosed
WO-2023063168-A1 PEST CONTROLLING COMPOSITION ダイキン工業株式会社 2023-04-20 WO disclosed
EP-0272816-A2 Ostomy pouch particularly suited for a disposal by flushing, method of assembling an ostomy pouch and method of disposing of a used pouch E.R. Squibb &amp; Sons, Inc. (US) 1988-06-29 EP disclosed
US-4584070-A Process for preparing para-aminophenol PPG INDUSTRIES, INC. (US) 1986-04-22 US disclosed
EP-0055924-B1 IMPROVED PROCESS FOR THE SELECTIVE PREPARATION OF P-AMINOPHENOL FROM NITROBENZENE MALLINCKRODT, INC.(a Missouri corporation) (US) 1984-10-03 EP disclosed
EP-0055924-A1 Improved process for the selective preparation of p-aminophenol from nitrobenzene MALLINCKRODT, INC.(a Missouri corporation) (US) 1982-07-14 EP disclosed
EP-0055924-A1 Improved process for the selective preparation of p-aminophenol from nitrobenzene MALLINCKRODT, INC.(a Missouri corporation) (US) 1982-07-14 EP disclosed
US-4307249-A DIMETHYLALKYLAMINE OXIDE SURFACTANT MALLINCKRODT, INC. (US) 1981-12-22 US disclosed
US-4307249-A DIMETHYLALKYLAMINE OXIDE SURFACTANT MALLINCKRODT, INC. (US) 1981-12-22 US disclosed