SCHEMBL5058576

SCHEMBL5058576

CCCC(OCC1CO1)C(C)(C)O[SiH3]

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
TSHR P16473 3/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.34
TP53 P04637 2/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 2/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 1/20 0.31
PPARG P37231 1/20 0.31
HIF1A Q16665 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
SCHEMBL529971 0.87 ALDH1A1 (0.41) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL12478071 0.78 ALDH1A1 (0.45) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL6406979 0.75 ALDH1A1 (0.38) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL2551787 0.73 ALDH1A1 (0.38) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL28510002 0.73 ALDH1A1 (0.40) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL28413921 0.72 SMN1; SMN2 (0.42) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL14893116 0.71 SMN1; SMN2 (0.45) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL18111 0.71 SMN1; SMN2 (0.45) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL3295337 0.70 ALDH1A1 (0.38) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
Water SCHEMBL10962120 0.70 SMN1; SMN2 (0.44) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1

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-20080022886-A1 COATING COMPOSITIONS EXHIBITING CORROSION RESISTANCE PROPERTIES, RELATED COATED SUBSTRATES, AND METHODS PPG INDUSTRIES OHIO, INC. (US) 2008-01-31 US disclosed