SCHEMBL5776341

SCHEMBL5776341

CC1=C([Fe]C2=C(C)C=CC2)CC=C1.CCC1=C([Fe]C2=C(CC)C=CC2)CC=C1

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
SCHEMBL3894435 1.00
SCHEMBL1133064 0.90
SCHEMBL1133086 0.83
SCHEMBL1132641 0.74
SCHEMBL2520673 0.71
SCHEMBL6895106 0.71
Carbon Monoxide SCHEMBL4021488 0.71
SCHEMBL11697034 0.69
SCHEMBL11591766 0.68
SCHEMBL3891709 0.68 ACHE (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1230327-B1 FUEL ADDITIVE FOR THE PREVENTION OF VALVE SEAT RECESSION ASS OCTEL (GB) 2006-06-07 EP disclosed
EP-1230327-A1 FUEL ADDITIVE FOR THE PREVENTION OF VALVE SEAT RECESSION The Associated Octel Company Limited (GB) 2002-08-14 EP disclosed
WO-2001016257-A1 FUEL ADDITIVE FOR THE PREVENTION OF VALVE SEAT RECESSION THE ASSOCIATED OCTEL COMPANY LIMITED (GB) 2001-03-08 WO disclosed
EP-0961821-A1 FUEL ADDITIVE CONTAINING AN IRON COMPLEX AND A LEAD COMPOUND THE ASSOCIATED OCTEL COMPANY LIMITED (GB) 1999-12-08 EP disclosed
WO-1998036039-A1 FUEL ADDITIVE CONTAINING AN IRON COMPLEX AND A LEAD COMPOUND THE ASSOCIATED OCTEL COMPANY (GB) 1998-08-20 WO disclosed