SCHEMBL28062843

SCHEMBL28062843

CCCC[Si](CCCC)(OCCC)c1cccc(Br)c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.38
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C19 P33261 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 1/20 0.33
FBP1 P09467 1/20 0.32
OGG1 O15527 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
ERBB2 P04626 1/20 0.32
ERBB4 Q15303 1/20 0.32
GABRA1 P14867 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 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
SCHEMBL17937823 0.94 EGFR (0.41) EGFRCYP1A2CYP2D6CYP2C19L3MBTL1
SCHEMBL28062837 0.91 EGFR (0.38) EGFRCYP1A2CYP2D6CYP2C19L3MBTL1
SCHEMBL17937666 0.89 CYP1A2 (0.37) EGFRCYP1A2CYP2D6CYP2C19L3MBTL1
SCHEMBL17937678 0.88 EGFR (0.41) EGFRCYP1A2CYP2D6CYP2C19L3MBTL1
SCHEMBL28062737 0.86 EGFR (0.39) EGFRCYP1A2CYP2D6CYP2C19L3MBTL1
SCHEMBL28062856 0.85 EGFR (0.38) EGFRCYP1A2CYP2D6CYP2C19L3MBTL1
SCHEMBL17937735 0.84 CYP1A2 (0.38) EGFRCYP1A2CYP2D6CYP2C19L3MBTL1
SCHEMBL17937760 0.83 EGFR (0.41) EGFRCYP1A2CYP2D6CYP2C19L3MBTL1
SCHEMBL28063084 0.82 KMT2A (0.41) ALDH1A1HPGD
SCHEMBL28062848 0.81 MGLL (0.35) CYP1A2CYP2D6CYP2C19L3MBTL1HPGD

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-105555901-A Polishing composition FUJIMI INC 2016-05-04 CN disclosed