SCHEMBL3179357

SCHEMBL3179357

CC1=CC(C)C(O)([Si](C)(C)C)C=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
SCHEMBL6987586 0.76
SCHEMBL28076039 0.72
SCHEMBL8927850 0.69
SCHEMBL7101727 0.67
SCHEMBL28156221 0.65
SCHEMBL3648196 0.65
SCHEMBL7632781 0.65
SCHEMBL25524339 0.65
SCHEMBL28628386 0.64
SCHEMBL29807506 0.64

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
US-7648966-B2 Mannose-6-phosphonate compounds for the treatment of inflammatory diseases Pharmaxis Pty Limited (AU) 2010-01-19 US disclosed
EP-1628987-B1 MANNOSE-6-PHOSPHONATE COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISEASES PHARMAXIS PTY LTD (AU) 2009-08-19 EP disclosed
US-20070082850-A1 Mannose-6-phosphonate compounds for the treatment of inflammatory diseases PHARMAXIX PTY LTD (AU) 2007-04-12 US disclosed
EP-1628987-A2 MANNOSE-6-PHOSPHONATE COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISEASES Pharmaxis Pty Ltd. (AU) 2006-03-01 EP disclosed
WO-2004104015-A2 MANNOSE-6-PHOSPHONATE COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISEASES PHARMAXIS PTY LTD. (AU) 2004-12-02 WO disclosed