SCHEMBL28064263

SCHEMBL28064263

CCC(C)(CC)O[SiH2]C=Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.40
HTR2A P28223 3/20 0.36
TRPA1 O75762 1/20 0.35
CYP3A4 P08684 2/20 0.35
MTOR P42345 2/20 0.35
CYP1A2 P05177 1/20 0.35
THPO P40225 1/20 0.35
HIF1A Q16665 1/20 0.35
RAB9A P51151 1/20 0.35
MAOB P27338 1/20 0.34
IDO1 P14902 1/20 0.34
CYP2C19 P33261 2/20 0.34
NPC1 O15118 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GMNN O75496 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
BLM P54132 1/20 0.34
PMP22 Q01453 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL28438264 0.86 RELA (0.40) RELATRPA1CYP3A4MTORCYP1A2
SCHEMBL27722650 0.82 TRPA1 (0.39) RELATRPA1CYP3A4CYP1A2MAOB
SCHEMBL12802373 0.77 TRPA1 (0.40) RELATRPA1CYP3A4CYP1A2MAOB
SCHEMBL1470882 0.74 RELA (0.48) RELATRPA1CYP3A4MTORCYP1A2
SCHEMBL17239119 0.74 HTR2A (0.40) HTR2ATRPA1CYP3A4MTORMAOB
SCHEMBL1470879 0.74 RELA (0.48) RELATRPA1CYP3A4MTORCYP1A2
SCHEMBL28064246 0.74 RELA (0.41) RELAHTR2ATRPA1CYP3A4MTOR
SCHEMBL1468386 0.71 TRPA1 (0.48) RELATRPA1CYP3A4CYP1A2MAOB
SCHEMBL1468384 0.71 TRPA1 (0.48) RELATRPA1CYP3A4CYP1A2MAOB
SCHEMBL8990017 0.71 MAOB (0.48) RELATRPA1CYP1A2MAOBIDO1

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
CN-108513626-A Dispersion liquid, coating fluid and heat ray shielding film 住友大阪水泥株式会社 2018-09-07 CN disclosed
CN-107406684-A Transparent resin composition and heat-ray shielding film 住友大阪水泥株式会社 2017-11-28 CN disclosed
CN-105579123-A Inorganic particle dispersion liquid, inorganic particle-containing composition, coating film, plastic base with coating film, and display device SUMITOMO OSAKA CEMENT CO LTD 2016-05-11 CN disclosed