SCHEMBL18796002

SCHEMBL18796002

C=CC[Si](C)(C)c1ccccc1S

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
HDAC8 Q9BY41 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL669066 0.80
SCHEMBL10913604 0.78 ALDH1A1 (0.39) NR1H2NR1H3ALDH1A1TSHR
SCHEMBL10941267 0.78 NR1H2 (0.38) NR1H2NR1H3ALDH1A1TSHR
SCHEMBL3700317 0.77 NR1H2 (0.37) NR1H2NR1H3ALDH1A1TSHR
SCHEMBL2003493 0.74 APOBEC3G (0.38) NR1H2NR1H3ALDH1A1
SCHEMBL18796346 0.74
SCHEMBL1147728 0.71 NR1H2 (0.53) NR1H2NR1H3ALDH1A1TSHRMEN1
SCHEMBL2141988 0.69 IDO1 (0.34) HDAC8
SCHEMBL18796087 0.69 MAPT (0.32) HDAC8
SCHEMBL29719052 0.69 IDO1 (0.34) HDAC8

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-108349897-B Trisubstituted silylphenoxyheterocycles and analogs 拜耳作物科学股份公司 2022-03-04 CN disclosed
EP-3368514-A1 TRISUBSTITUTEDSILYLPHENOXYHETEROCYCLES AND ANALOGUES Bayer CropScience Aktiengesellschaft (DE) 2018-09-05 EP disclosed
WO-2017072283-A1 TRISUBSTITUTEDSILYLPHENOXYHETEROCYCLES AND ANALOGUES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-05-04 WO disclosed