SCHEMBL2425940

SCHEMBL2425940

CC(N)=CNCC(C)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
SCHEMBL20814339 0.78
SCHEMBL2431063 0.77 KDM4E (0.30)
SCHEMBL11418862 0.77 ALDH1A1 (0.33)
SCHEMBL18231678 0.77
SCHEMBL11383392 0.76 CASR (0.35)
SCHEMBL11371465 0.74 TSHR (0.31)
SCHEMBL11405304 0.74 MAPT (0.41)
SCHEMBL2957915 0.69
SCHEMBL23336624 0.69
SCHEMBL13784825 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110232489-A1 METHOD TO DECREASE DECOMPOSITION PRODUCTS IN SOLUTIONS THAT ABSORB ACIDIC GASES SUCH AS CARBON DIOXIDE AND THE LIKE IN THE PRESENCE OF OXYGEN HUNTSMAN PETROCHEMICAL LLC (US) 2011-09-29 US claimed
US-7169268-B2 Storage stability; discoloration inhibition; mixing with ethyleneamine; distillation HUNTSMAN PETROCHEMICAL CORPORATION (US) 2007-01-30 US claimed
US-20040000471-A1 Color stabilization of amines HUNTSMAN PETROCHEMICAL CORPORATION (US) 2004-01-01 US claimed
EP-1362262-A1 SEMICONDUCTOR DEVELOPING AGENT HUNTSMAN PETROCHEMICAL CORPORATION (US) 2003-11-19 EP claimed
WO-2002069052-A1 SEMICONDUCTOR DEVELOPING AGENT HUNTSMAN PETROCHEMICAL CORPORATION (US) 2002-09-06 WO claimed
US-6340559-B1 IN THE MANUFACTURE OF INTEGRATED CIRCUITS HUNTSMAN PETROCHEMICAL CORPORATION 2002-01-22 US claimed
EP-2373760-B1 DECREASED PRESENCE OF AMINE-DERIVED CONTAMINANTS IN- AND/OR DEGRADATION OF AMINE SOLVENT SOLUTIONS HUNTSMAN PETROCHEMICAL LLC (US) 2016-08-03 EP disclosed
US-8945280-B2 Method to decrease decomposition products in solutions that absorb acidic gases such as carbon dioxide and the like in the presence of oxygen HUNTSMAN PETROCHEMICAL LLC (US) 2015-02-03 US disclosed
EP-2373760-A1 DECREASED PRESENCE OF AMINE-DERIVED CONTAMINANTS IN- AND/OR DEGRADATION OF AMINE SOLVENT SOLUTIONS Huntsman Petrochemical LLC (US) 2011-10-12 EP disclosed
US-20110232489-A1 METHOD TO DECREASE DECOMPOSITION PRODUCTS IN SOLUTIONS THAT ABSORB ACIDIC GASES SUCH AS CARBON DIOXIDE AND THE LIKE IN THE PRESENCE OF OXYGEN HUNTSMAN PETROCHEMICAL LLC (US) 2011-09-29 US disclosed
WO-2010077548-A1 DECREASED PRESENCE OF AMINE-DERIVED CONTAMINANTS IN- AND/OR DEGRADATION OF AMINE SOLVENT SOLUTIONS HUNTSMAN PETROCHEMICAL LLC (US) 2010-07-08 WO disclosed
US-7169268-B2 Storage stability; discoloration inhibition; mixing with ethyleneamine; distillation HUNTSMAN PETROCHEMICAL CORPORATION (US) 2007-01-30 US disclosed
US-20040000471-A1 Color stabilization of amines HUNTSMAN PETROCHEMICAL CORPORATION (US) 2004-01-01 US disclosed
US-6340559-B1 IN THE MANUFACTURE OF INTEGRATED CIRCUITS HUNTSMAN PETROCHEMICAL CORPORATION 2002-01-22 US disclosed
US-4469856-A Non-crystalline polyamine/carbonic acid salt compositions, a process for their preparation and their use for the production of polyurethane ureas, especially foamed coatings BAYER AKTIENGESELLSCHAFT (DE) 1984-09-04 US disclosed