SCHEMBL4451456

SCHEMBL4451456

CC(C)[Si](CCCC#N)(O[SiH3])C(C)C

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36

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
SCHEMBL6515508 0.81 TSHR (0.37) TSHR
SCHEMBL3151863 0.74 TSHR (0.39) TSHR
SCHEMBL3153547 0.72 TSHR (0.33) TSHR
SCHEMBL17666183 0.69 TSHR (0.42) TSHR
SCHEMBL16724851 0.69 TSHR (0.42) TSHR
SCHEMBL523935 0.67 TSHR (0.40) TSHR
SCHEMBL31599249 0.67 TSHR (0.40) TSHR
SCHEMBL31599248 0.67 TSHR (0.40) TSHR
SCHEMBL31599230 0.67 TSHR (0.40) TSHR
SCHEMBL30690932 0.67 TSHR (0.40) TSHR

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
US-7628915-B2 Metal cyano bonded phases VARIAN, INC. (US) 2009-12-08 US disclosed
WO-2008070153-A1 METAL CYANO BONDED PHASES VARIAN, INC. (US) 2008-06-12 WO disclosed
US-20080135485-A1 With a metal substrate; high performance liquid chromatography; improved storage stability VARIAN, INC. 2008-06-12 US disclosed