SCHEMBL28290045

SCHEMBL28290045

CCc1ccccc1[SiH](CC)CC

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.41
GABRB2 P47870 4/20 0.41
MGLL Q99685 1/20 0.38
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
MAPT P10636 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TP53 P04637 1/20 0.35
ALDH1A1 P00352 3/20 0.34
POLB P06746 2/20 0.34
CYP2D6 P10635 1/20 0.33
HTT P42858 1/20 0.33
GAA P10253 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
SCHEMBL27924053 0.82 LIPG (0.33) TAS1R3TAS1R1ALDH1A1GAA
SCHEMBL6114181 0.82 TP53 (0.36) TP53
SCHEMBL20637440 0.78 GABRA1 (0.42) GABRA1GABRB2MGLLMAPTNPSR1
SCHEMBL28730873 0.77 GABRA1 (0.40) GABRA1GABRB2MAPTALDH1A1CYP2D6
SCHEMBL6114728 0.76 GABRA1 (0.46) GABRA1GABRB2MGLLMAPTNPSR1
SCHEMBL28853525 0.76 GABRA1 (0.41) GABRA1GABRB2MGLLMAPTNPSR1
SCHEMBL21383367 0.76 GABRA1 (0.41) GABRA1GABRB2MGLLMAPTNPSR1
SCHEMBL1917938 0.76 GABRA1 (0.46) GABRA1GABRB2MGLLMAPTNPSR1
SCHEMBL115194 0.76 MGLL (0.42) GABRA1GABRB2MGLLMAPTNPSR1
SCHEMBL21383150 0.74 GABRA1 (0.39) GABRA1GABRB2MGLLMAPTNPSR1

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-109641482-A The preparation of the cis- -1,4- polydiene of multiple silane functionals with the Si―H addition reaction in situ preparation by polymer glue 株式会社普利司通 2019-04-16 CN disclosed