SCHEMBL4529620

SCHEMBL4529620

CCC[Si](O)(O)CCCN

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 8/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
EPHX1 P07099 1/20 0.39
GABBR2 O75899 2/20 0.38
GABBR1 Q9UBS5 2/20 0.38
GABRR1 P24046 1/20 0.38
NFKB1 P19838 1/20 0.30

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
SCHEMBL4528172 0.90 DNM1 (0.48) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL4513305 0.90 DNM1 (0.48) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL4525990 0.90 DNM1 (0.48) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL4525210 0.86 NFKB1 (0.40) DNM1KMT2ATSHRGABBR2GABBR1
SCHEMBL4527178 0.82 DNM1 (0.50) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL16784960 0.81
SCHEMBL4522702 0.80 DNM1 (0.55) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL839550 0.80
SCHEMBL4816403 0.78 DNM1 (0.43) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL21748457 0.78 DNM1 (0.43) DNM1MEN1KMT2AALDH1A1TSHR

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