SCHEMBL4529300

SCHEMBL4529300

CNCCCC[Si](O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.33
SIGMAR1 Q99720 2/20 0.32
PAOX Q6QHF9 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MAPK1 P28482 1/20 0.31
HIF1A Q16665 1/20 0.31
KDM4A O75164 1/20 0.31
KDM4C Q9H3R0 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL4533873 0.97 EPHX1 (0.48) EPHX1L3MBTL1SIGMAR1PAOXKDM4E
SCHEMBL4536320 0.97 EPHX1 (0.48) EPHX1L3MBTL1SIGMAR1PAOXKDM4E
SCHEMBL4531106 0.92
SCHEMBL4517034 0.81 EPHX1 (0.42) EPHX1L3MBTL1SIGMAR1PAOXKDM4E
SCHEMBL4533867 0.79
SCHEMBL4530750 0.79 EPHX1 (0.46) EPHX1L3MBTL1SIGMAR1PAOXKDM4E
SCHEMBL4533506 0.79 EPHX1 (0.46) EPHX1L3MBTL1SIGMAR1PAOXKDM4E
SCHEMBL331659 0.74
SCHEMBL26668759 0.72
SCHEMBL15985530 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7507480-B2 Corrosion-resistant metal surfaces BROOKHAVEN SCIENCE ASSOCIATES, LLC (US) 2009-03-24 US disclosed
US-20060269760-A1 Corrosion-resistant metal surfaces ENERGY, UNITED STATES DEPARTMENT OF 2006-11-30 US disclosed