SCHEMBL9317153

SCHEMBL9317153

CC(C)(C#N)[Si](C)(C)C.CCOC(=O)C[Si](C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.39
TSHR P16473 1/20 0.39
GAA P10253 4/20 0.39
MGAM O43451 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
TRPA1 O75762 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
MAPT P10636 2/20 0.35
KDM4E B2RXH2 4/20 0.33
CYP1A2 P05177 1/20 0.32
GLA P06280 1/20 0.32
HPGD P15428 2/20 0.32
MMP3 P08254 1/20 0.32
HSD17B10 Q99714 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL435045 0.80 GAA (0.57) ALDH1A1TSHRGAAMGAMSI
SCHEMBL4869552 0.69 GAA (0.44) ALDH1A1TSHRGAAMGAMSI
SCHEMBL17034713 0.69 GAA (0.44) ALDH1A1TSHRGAAMGAMSI
SCHEMBL12715665 0.67 GAA (0.46) ALDH1A1TSHRGAAMGAMSI
SCHEMBL631915 0.67 GAA (0.57) ALDH1A1TSHRGAAMGAMSI
SCHEMBL13680122 0.67 GAA (0.52) ALDH1A1TSHRGAAMGAMSI
SCHEMBL5362609 0.67 CYP1A2 (0.42) ALDH1A1TSHRGAAMGAMSI
SCHEMBL14157029 0.67 CYP1A2 (0.42) ALDH1A1TSHRGAAMGAMSI
SCHEMBL28242894 0.66 MEN1 (0.53) ALDH1A1TSHRGAAMGAMSI
SCHEMBL28242892 0.66 MEN1 (0.53) ALDH1A1TSHRGAAMGAMSI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5359018-A Group transfer polymerization using initiator and zinc, cadmium, or mercury halides and iodine as catalysts DOW CORNING CORPORATION (US) 1994-10-25 US disclosed