SCHEMBL3687753

SCHEMBL3687753

C=CCCC(N)CC=C

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
SCHEMBL1243017 0.85 TSHR (0.35)
SCHEMBL22651490 0.84 ALDH1A1 (0.36)
SCHEMBL8606471 0.80 GRIK1 (0.32)
SCHEMBL174163 0.78
SCHEMBL11422444 0.78 ALDH1A1 (0.34)
SCHEMBL10454796 0.78
SCHEMBL175675 0.78
SCHEMBL4177076 0.76
Hydrochloric Acid SCHEMBL6288816 0.76 ALDH1A1 (0.33)
SCHEMBL22117219 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6579997-B1 Enhanced activity of metal complexes UAB RESEARCH FOUNDATION 2003-06-17 US claimed
EP-1212134-A4 METALLACROWN ETHER CATALYSTS FOR HYDROFORMYLATION UAB RESEARCH FOUNDATION (US) 2003-01-22 EP claimed
EP-1212134-A1 METALLACROWN ETHER CATALYSTS FOR HYDROFORMYLATION UAB Research Foundation (US) 2002-06-12 EP claimed
EP-1066236-A4 PROCESS FOR HYDROCARBONYLATIONS IN SUPERCRITICAL CARBON DIOXIDE RES FOUNDATION OF (US) 2001-06-06 EP claimed
WO-2001007156-A1 METALLACROWN ETHER CATALYSTS FOR HYDROFORMYLATION UAB RESEARCH FOUNDATION (US) 2001-02-01 WO claimed
EP-1066236-A1 PROCESS FOR HYDROCARBONYLATIONS IN SUPERCRITICAL CARBON DIOXIDE The Research Foundation of State University of New York (US) 2001-01-10 EP claimed
WO-1999050214-A1 PROCESS FOR HYDROCARBONYLATIONS IN SUPERCRITICAL CARBON DIOXIDE THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1999-10-07 WO claimed
US-5962744-A USING CATALYST COMPLEX CONTAINING TRANSITION METAL AND PHOSPHITE LIGAND THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1999-10-05 US claimed
CN-118324715-A Compounds, compositions, and methods of use thereof 艾勒维生技公司 2024-07-12 CN disclosed
CN-117750962-A Compounds, compositions, and methods of use thereof 艾勒维生技公司 2024-03-22 CN disclosed
US-20100298504-A1 AMPHIPHILIC POLYMER AND PROCESSES OF FORMING THE SAME AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2010-11-25 US disclosed
US-6579997-B1 Enhanced activity of metal complexes UAB RESEARCH FOUNDATION 2003-06-17 US disclosed
EP-1212134-A4 METALLACROWN ETHER CATALYSTS FOR HYDROFORMYLATION UAB RESEARCH FOUNDATION (US) 2003-01-22 EP disclosed
EP-1212134-A1 METALLACROWN ETHER CATALYSTS FOR HYDROFORMYLATION UAB Research Foundation (US) 2002-06-12 EP disclosed
EP-1066236-A4 PROCESS FOR HYDROCARBONYLATIONS IN SUPERCRITICAL CARBON DIOXIDE RES FOUNDATION OF (US) 2001-06-06 EP disclosed
WO-2001007156-A1 METALLACROWN ETHER CATALYSTS FOR HYDROFORMYLATION UAB RESEARCH FOUNDATION (US) 2001-02-01 WO disclosed
EP-1066236-A1 PROCESS FOR HYDROCARBONYLATIONS IN SUPERCRITICAL CARBON DIOXIDE The Research Foundation of State University of New York (US) 2001-01-10 EP disclosed
WO-1999050214-A1 PROCESS FOR HYDROCARBONYLATIONS IN SUPERCRITICAL CARBON DIOXIDE THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1999-10-07 WO disclosed
US-5962744-A USING CATALYST COMPLEX CONTAINING TRANSITION METAL AND PHOSPHITE LIGAND THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1999-10-05 US disclosed