SCHEMBL29007128

SCHEMBL29007128

C=Cc1ccccc1C=C.CCO[SiH](C)OCC

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
TSHR P16473 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
SCHEMBL27702911 0.82 ALDH1A1 (0.38) ALDH1A1
Styrene SCHEMBL27776761 0.82 ALDH1A1 (0.54) ALDH1A1TSHR
Ether SCHEMBL9406240 0.79 ALDH1A1 (0.44) ALDH1A1TSHR
SCHEMBL812109 0.77 ALDH1A1 (0.36) ALDH1A1
SCHEMBL29066951 0.77 ALDH1A1 (0.48) ALDH1A1TSHR
SCHEMBL9639871 0.74 ALDH1A1 (0.34) ALDH1A1TSHR
Biphenyl SCHEMBL28295625 0.74 ALDH1A1 (0.43) ALDH1A1
SCHEMBL28092588 0.73 ALDH1A1 (0.48) ALDH1A1TSHR
Alcohol SCHEMBL28563139 0.73 ALDH1A1 (0.48) ALDH1A1TSHR
Methoxymethane SCHEMBL29277822 0.73 ALDH1A1 (0.52) ALDH1A1TSHR

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
CN-116144183-A High-temperature vulcanized silicone rubber and preparation method thereof 山东大学 2023-05-23 CN disclosed