SCHEMBL89085

SCHEMBL89085

C=C(O)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
SCHEMBL10525839 0.93
SCHEMBL11441884 0.85
SCHEMBL5143874 0.79
SCHEMBL20440770 0.75
SCHEMBL14701758 0.73 CA1 (0.38)
SCHEMBL10709266 0.73
SCHEMBL12014089 0.73
SCHEMBL18739767 0.73
SCHEMBL11870620 0.71
SCHEMBL10268409 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 169 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11136434-B2 Polyamines, synthesis method thereof and use thereof for the selective elimination of H2S from a gaseous effluent comprising CO2 IFP Energies Nouvelles (FR) 2021-10-05 US claimed
US-20200148824-A1 NOVEL POLYAMINES, SYNTHESIS METHOD THEREOF AND USE THEREOF FOR THE SELECTIVE ELIMINATION OF H2S FROM A GASEOUS EFFLUENT COMPRISING CO2 IFP Energies Nouvelles (FR) 2020-05-14 US claimed
EP-3645605-A1 NOVEL POLYAMINES, SYNTHESIS METHOD THEREOF AND USE THEREOF FOR THE SELECTIVE ELEMINATION OF H2S FROM A GASEOUS EFFLUENT COMPRISING C02 IFP Energies nouvelles (FR) 2020-05-06 EP claimed
EP-3397671-B1 NOVEL POLYAMINES, SYNTHESIS PROCESS THEREOF AND USE OF SAME FOR THE SELECTIVE ELIMINATION OF H2S FROM A GASEOUS EFFLUENT COMPRISING CO2 IFP ENERGIES NOW (FR) 2020-02-12 EP claimed
WO-2018224350-A1 NOVEL POLYAMINES, SYNTHESIS METHOD THEREOF AND USE THEREOF FOR THE SELECTIVE ELIMINATION OF H2S FROM A GASEOUS EFFLUENT COMPRISING CO2 IFP Energies Nouvelles (FR) 2018-12-13 WO claimed
EP-3397671-A1 NOVEL POLYAMINES, SYNTHESIS PROCESS THEREOF AND USE OF SAME FOR THE SELECTIVE ELIMINATION OF H2S FROM A GASEOUS EFFLUENT COMPRISING CO2 IFP Energies nouvelles (FR) 2018-11-07 EP claimed
WO-2017097716-A1 NOVEL POLYAMINES, SYNTHESIS PROCESS THEREOF AND USE OF SAME FOR THE SELECTIVE ELIMINATION OF H2S FROM A GASEOUS EFFLUENT COMPRISING CO2 IFP Energies Nouvelles (FR) 2017-06-15 WO claimed
WO-2016142125-A1 ABSORBENT SOLUTION BASED ON AMINES COMPRISING A TERTIARY POLYETHERALKANOLAMINE, AND PROCESS FOR SELECTIVE ELIMINATION OF HYDROGEN SULPHIDE FROM A GASEOUS EFFLUENT COMPRISING CARBON DIOXIDE IFP Energies Nouvelles (FR) 2016-09-15 WO claimed
WO-2016142126-A1 NOVEL TERTIARY POLYETHER ALKANOLAMINES, METHOD FOR SYNTHESIS THEREOF, AND USE OF SAME FOR THE SELECTIVE REMOVAL OF THE HYDROGEN SULPHIDE FROM A GAS EFFLUENT COMPRISING CARBON DIOXIDE IFP Energies Nouvelles (FR) 2016-09-15 WO claimed
US-4824603-A Amphoteric and zwitter-ionic phosphate surfactants HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1989-04-25 US claimed
EP-0265824-A2 Amphoteric and zwitterionic tensioactive phosphates Henkel Kommanditgesellschaft auf Aktien (DE) 1988-05-04 EP claimed
JP-4208253-A None JP disclosed
US-11384033-B2 Compositions with improved urease-inhibiting effect comprising (thio)phosphoric acid triamide and further compounds such as amines and colorants BASF SE (DE) 2022-07-12 US disclosed
CN-107108388-B Composition comprising (thio) phosphoric triamide and other compounds such as amines and colorants with improved urease-inhibiting effect 巴斯夫欧洲公司 2021-02-26 CN disclosed
CN-112374933-A Composition comprising (thio) phosphoric triamide and other compounds such as amines and colorants with improved urease-inhibiting effect 巴斯夫欧洲公司 2021-02-19 CN disclosed
EP-0001996-A1 Process for the preparation of N,N-bis-(2-hydroxyalkyl)-aminomethane-phosphonic acid dimethyl esters, and their use as flame retardants for polymers BAYER AG (DE) 1979-05-30 EP disclosed
US-4073908-A PSYCHOTROPIC ACTIVITY LABORATOIRE LE BRUN S.A. (FR) 1978-02-14 US disclosed
US-4068077-A Manufacture of N-substituted tetrahydro-1,4-oxazines BASF AKTIENGESELLSCHAFT (DT) 1978-01-10 US disclosed
US-4068077-A Manufacture of N-substituted tetrahydro-1,4-oxazines BASF AKTIENGESELLSCHAFT (DT) 1978-01-10 US disclosed
US-4060571-A FROM AN OXAZOLIDINE AND A DIALKYL PHOSPHITE BAYER AKTIENGESELLSCHAFT (DT) 1977-11-29 US disclosed