SCHEMBL28062816

SCHEMBL28062816

CCC(C)(CC)O[SiH2]c1cccc(Br)c1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.39
MAOA P21397 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPK1 P28482 1/20 0.35
IDO1 P14902 2/20 0.33
AGXT P21549 2/20 0.33
TP53BP1 Q12888 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.32
SLC6A19 Q695T7 1/20 0.32
MAOB P27338 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TAAR1 Q96RJ0 2/20 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
SCHEMBL28062865 0.84 ALDH1A1 (0.39) RIPK1MAOAALDH1A1MAPK1IDO1
SCHEMBL28010858 0.79
SCHEMBL28062829 0.79 RIPK1 (0.39) RIPK1ALDH1A1IDO1AGXTKMT2A
SCHEMBL28062805 0.78 ALDH1A1 (0.33) ALDH1A1HPGD
SCHEMBL8722505 0.75 RIPK1 (0.38) RIPK1MAOAALDH1A1MAPK1IDO1
SCHEMBL712794 0.75 CYP1A2 (0.30)
SCHEMBL28062846 0.74 MAOA (0.37) MAOAALDH1A1MAPK1IDO1AGXT
SCHEMBL8723539 0.70 ALDH1A1 (0.43) RIPK1MAOAALDH1A1MAPK1IDO1
SCHEMBL2950779 0.69
SCHEMBL6708613 0.67 CYP1A2 (0.35) RIPK1ALDH1A1MAPK1MEN1KMT2A

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