SCHEMBL6868149

SCHEMBL6868149

CCC(CC)(CCCN)NCC(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
SCHEMBL28121813 0.83 GGPS1 (0.31)
SCHEMBL28121797 0.80 TSHR (0.38)
SCHEMBL21093333 0.74 TDP1 (0.33)
SCHEMBL11821293 0.72 TSHR (0.36)
SCHEMBL27943013 0.70 MAPK1 (0.30)
SCHEMBL25408854 0.69 DNM1 (0.32)
SCHEMBL7098358 0.67 DNM1 (0.39)
SCHEMBL7093917 0.67 DNM1 (0.39)
SCHEMBL6213345 0.66 TDP1 (0.38)
SCHEMBL12423880 0.65 TSHR (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0938501-B1 PROCESS FOR THE PURIFICATION OF HUMAN INTERLEUKIN-1 RECEPTOR ANTAGONIST FROM RECOMBINANT E. COLI AVENTIS BULK S P A (IT) 2004-07-28 EP claimed
EP-0938501-B1 PROCESS FOR THE PURIFICATION OF HUMAN INTERLEUKIN-1 RECEPTOR ANTAGONIST FROM RECOMBINANT E. COLI AVENTIS BULK S P A (IT) 2004-07-28 EP disclosed
US-6573366-B1 Loading the mixture onto a cationic exchange matrix and eluting with a buffered solution; applying onto an anionic exchange matrix, eluting and recovering GRUPPO LEPETIT S.P.A. (IT) 2003-06-03 US disclosed