SCHEMBL378843

SCHEMBL378843

C=C(CCCNC(C)=O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.54
MAPK1 P28482 1/20 0.54
HIF1A Q16665 1/20 0.54
ADRA1A P35348 1/20 0.53
PAOX Q6QHF9 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 1/20 0.40
FOLH1 Q04609 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MTNR1A P48039 4/20 0.35
MTNR1B P49286 4/20 0.35
TBXAS1 P24557 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL9841123 0.94 ADRA1A (0.62) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL17959820 0.92 ADRA1A (0.66) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL4939278 0.87 ADRA1A (0.47) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL1880850 0.84 PLA2G4A (0.39) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL13176792 0.83 KDM4E (0.58) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL1011841 0.83 ALOX15 (0.35) KDM4EMAPK1HIF1AADRA1ATBXAS1
SCHEMBL4596050 0.82 MEN1 (0.38) KDM4EMAPK1HIF1AADRA1AL3MBTL1
SCHEMBL8544799 0.80 KEAP1 (0.42) ADRA1A
SCHEMBL13504177 0.80 EPHX1 (0.50) ADRA1ATSHR
SCHEMBL472248 0.79 TBXAS1 (0.33) KDM4EADRA1ATBXAS1

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-20240108000-A1 DISINFECTANT COMPOSITIONS EXHIBITING ENHANCED BIOCIDAL BENEFITS PILOT CHEMICAL CORP. 2024-04-04 US claimed
US-20240108000-A1 DISINFECTANT COMPOSITIONS EXHIBITING ENHANCED BIOCIDAL BENEFITS PILOT CHEMICAL CORP. 2024-04-04 US disclosed
EP-1664228-B1 ADHESIVE COMPOSITION WITH BARRIER CHARACTERISTICS HENKEL AG & CO KGAA (DE) 2012-01-25 EP disclosed
US-7419564-B2 Binding agents having barrier properties HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-09-02 US disclosed
US-20060162860-A1 Binding agents having barrier properties HENKEL AG & CO. KGAA (DE) 2006-07-27 US disclosed
EP-1664228-A1 ADHESIVE COMPOSITION WITH BARRIER CHARACTERISTICS Henkel Kommanditgesellschaft auf Aktien (DE) 2006-06-07 EP disclosed
EP-1664226-A1 BINDING AGENTS HAVING BARRIER PROPERTIES Henkel Kommanditgesellschaft auf Aktien (DE) 2006-06-07 EP disclosed
WO-2005033240-A1 BINDING AGENTS HAVING BARRIER PROPERTIES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-04-14 WO disclosed
WO-2005033242-A1 ADHESIVE COMPOSITION WITH BARRIER CHARACTERISTICS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-04-14 WO disclosed
EP-0998548-B1 AUTOMATIC DISHWASHING COMPOSITIONS CONTAINING WATER SOLUBLE CATIONIC OR AMPHOTERIC POLYMERS UNILEVER NV (NL) 2004-09-29 EP disclosed
US-6281180-B1 Automatic dishwashing compositions containing water soluble cationic or amphoteric polymers LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. 2001-08-28 US disclosed
US-6239091-B1 REDUCING FORMATION OF SPOTS AND FILMS ON WASHED GLASSWARE BY INCORPORATING WATER SOLUBLE, CATIONIC OR AMPHOTERIC POLYMERS IN AUTOMATIC DISHWASHING PROCESS LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. 2001-05-29 US disclosed
EP-1078032-A1 MACHINE DISHWASHING COMPOSITIONS AND RINSE AID COMPOSITIONS UNILEVER PLC (GB) 2001-02-28 EP disclosed
WO-1999058633-A1 MACHINE DISHWASHING COMPOSITIONS AND RINSE AID COMPOSITIONS UNILEVER PLC (GB) 1999-11-18 WO disclosed
US-5981456-A CONSISTS OF A POLYAMIDE CATIONIC POLYMER MODIFIED BY EPICHLOROHYDRIN AND 1,2-DIHYDROXYBUTYLENEDIAMINE, N,N'-TERTRAMETHYL- AND PHOSPHATE OR NONPHOSPHATE SOAP BUILDERS LEVER BROTHERS COMPANY (US) 1999-11-09 US disclosed