SCHEMBL5488456

SCHEMBL5488456

CCO[Si](Cc1cc(-c2ccccc2)c(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1)(OCC)OCC

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
HPGD P15428 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
LMNA P02545 2/20 0.33
KDM4E B2RXH2 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SQOR Q9Y6N5 1/20 0.33
USP7 Q93009 2/20 0.33
GCGR P47871 1/20 0.33
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
GPR55 Q9Y2T6 1/20 0.32
CYP1A2 P05177 1/20 0.32
XBP1 P17861 1/20 0.32
CYP2C19 P33261 1/20 0.32
MEN1 O00255 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
SCHEMBL5487167 0.75 ALDH1A1 (0.35) ALDH1A1HPGDSMN1; SMN2LMNAKDM4E
SCHEMBL1225414 0.68 BACE1 (0.50) ALDH1A1HPGDSMN1; SMN2LMNAKDM4E
SCHEMBL104109 0.67 TP53 (0.44) ALDH1A1SMN1; SMN2KDM4ETP53
SCHEMBL8142412 0.66 TAAR1 (0.41) ALDH1A1SMN1; SMN2NPC1RAB9AMAPT
Biphenyl SCHEMBL21835012 0.65 ALDH1A1 (0.39) ALDH1A1HPGDSMN1; SMN2LMNAKDM4E
SCHEMBL2901415 0.65 CYP4F2 (0.31) MAPTNPSR1
SCHEMBL1963873 0.65 IDO1 (0.42) ALDH1A1HPGDSMN1; SMN2MAPTMEN1
SCHEMBL6473234 0.65 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2MAPTNPSR1CYP1A2
SCHEMBL19809277 0.65 HSPA5 (0.45) KDM4E
SCHEMBL29287974 0.64 DHFR (0.41) LMNAMAPTUSP7GCGRKMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7291747-B2 Silicon compounds and process for preparation thereof CHISSO CORPORATION (JP) 2007-11-06 US disclosed
US-20040143081-A1 Novel silicon compounds and process for preparation thereof JNC CORPORATION (JP) 2004-07-22 US disclosed