SCHEMBL28062830

SCHEMBL28062830

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

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C19 P33261 2/20 0.38
EGFR P00533 5/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
GAA P10253 1/20 0.34
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
FBP1 P09467 1/20 0.33
MAPK1 P28482 1/20 0.33
OGG1 O15527 1/20 0.33
ERBB2 P04626 1/20 0.33
ERBB4 Q15303 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL28062802 0.90 L3MBTL1 (0.38) CYP1A2CYP2D6CYP2C19EGFRL3MBTL1
SCHEMBL28062832 0.86 CYP1A2 (0.37) CYP1A2CYP2D6CYP2C19EGFRL3MBTL1
SCHEMBL28062801 0.84 EGFR (0.41) CYP1A2CYP2D6CYP2C19EGFRL3MBTL1
SCHEMBL28062856 0.84 EGFR (0.38) CYP1A2CYP2D6CYP2C19EGFRL3MBTL1
SCHEMBL17937735 0.84 CYP1A2 (0.38) CYP1A2CYP2D6CYP2C19EGFRL3MBTL1
SCHEMBL28062705 0.83 ALDH1A1 (0.38) CYP1A2EGFRL3MBTL1GAAALDH1A1
SCHEMBL28062750 0.81 KMT2A (0.40) GAAALDH1A1HPGD
SCHEMBL28827561 0.80 MGLL (0.36) CYP1A2CYP2D6CYP2C19L3MBTL1HPGD
SCHEMBL8723550 0.80 CYP1A2 (0.41) CYP1A2CYP2D6CYP2C19EGFRL3MBTL1
SCHEMBL704368 0.79 LTA4H (0.37) CYP1A2CYP2C19GAALMNA

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