SCHEMBL6672448

SCHEMBL6672448

C=CC(O)CNCCC

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
SCHEMBL6672166 0.87 TSHR (0.41)
SCHEMBL6672469 0.81
SCHEMBL16925398 0.80 SLC6A2 (0.32)
SCHEMBL6672159 0.79
SCHEMBL11474159 0.77
Ammonia Solution, Strong SCHEMBL6676286 0.77
SCHEMBL9232154 0.76 ANPEP (0.38)
SCHEMBL17006250 0.74 ALDH1A1 (0.32)
SCHEMBL11467053 0.74 CASP2 (0.42)
SCHEMBL9123994 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1289973-B1 PROCESS FOR THE REMOVAL OF CARBON DIOXIDE FROM 3,4-EPOXY-1-BUTENE PROCESS RECYCLE STREAMS EASTMAN CHEM CO (US) 2004-10-06 EP claimed
EP-1289973-A1 PROCESS FOR THE REMOVAL OF CARBON DIOXIDE FROM 3,4-EPOXY-1-BUTENE PROCESS RECYCLE STREAMS EASTMAN CHEMICAL COMPANY (US) 2003-03-12 EP claimed
WO-2001098285-A1 PROCESS FOR THE REMOVAL OF CARBON DIOXIDE FROM 3,4-EPOXY-1-BUTENE PROCESS RECYCLE STREAMS EASTMAN CHEMICAL COMPANY (US) 2001-12-27 WO claimed
US-6270739-B1 CARBON DIOXIDE AT LOW PARTIAL PRESSURE IS ABSORBED INTO AN ALKANOLAMINE SOLUTION FROM A LOW PRESSURE RECYCLE GAS STREAM CONTAINING HIGH LEVELS OF OXYGEN. EASTMAN CHEMICAL COMPANY 2001-08-07 US claimed
EP-1289973-B1 PROCESS FOR THE REMOVAL OF CARBON DIOXIDE FROM 3,4-EPOXY-1-BUTENE PROCESS RECYCLE STREAMS EASTMAN CHEM CO (US) 2004-10-06 EP disclosed
EP-1289973-A1 PROCESS FOR THE REMOVAL OF CARBON DIOXIDE FROM 3,4-EPOXY-1-BUTENE PROCESS RECYCLE STREAMS EASTMAN CHEMICAL COMPANY (US) 2003-03-12 EP disclosed
WO-2001098285-A1 PROCESS FOR THE REMOVAL OF CARBON DIOXIDE FROM 3,4-EPOXY-1-BUTENE PROCESS RECYCLE STREAMS EASTMAN CHEMICAL COMPANY (US) 2001-12-27 WO disclosed
US-6270739-B1 CARBON DIOXIDE AT LOW PARTIAL PRESSURE IS ABSORBED INTO AN ALKANOLAMINE SOLUTION FROM A LOW PRESSURE RECYCLE GAS STREAM CONTAINING HIGH LEVELS OF OXYGEN. EASTMAN CHEMICAL COMPANY 2001-08-07 US disclosed