SCHEMBL3744175

SCHEMBL3744175

CCO[SiH](Cc1ccc2c(c1)C(=O)OC2=O)OCC

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.37
MAPK1 P28482 2/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALOX15 P16050 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TSHR P16473 1/20 0.33
GLA P06280 1/20 0.32
KMT2A Q03164 1/20 0.32
TRPA1 O75762 1/20 0.31
TYMS P04818 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
SCHEMBL3747320 0.84 ALDH1A1 (0.38) ALDH1A1MAPK1NPC1LMNAMAPT
SCHEMBL16592547 0.82 ALDH1A1 (0.33) ALDH1A1MAPK1NPC1LMNAMAPT
SCHEMBL4958672 0.76 ALDH1A1 (0.60) ALDH1A1MAPK1NPC1LMNAMAPT
SCHEMBL3747823 0.75 ALOX15 (0.41) ALDH1A1MAPK1NPC1LMNAMAPT
SCHEMBL3751148 0.74 ALDH1A1 (0.38) ALDH1A1MAPK1ALOX15TDP1TSHR
SCHEMBL19950404 0.73 CNR1 (0.50) ALDH1A1MAPK1NPC1LMNAMAPT
SCHEMBL16592686 0.72 GPR3 (0.35) ALDH1A1MAPK1NPC1LMNAMAPT
SCHEMBL7599687 0.72 ALOX15 (0.50) ALDH1A1MAPK1NPC1LMNAMAPT
SCHEMBL434869 0.72 ALOX15 (0.50) ALDH1A1MAPK1NPC1LMNAMAPT
Cyclopropane SCHEMBL11642163 0.71 ALDH1A1 (0.55) ALDH1A1MAPK1NPC1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7834120-B2 Monofunctional monomer having cage oligosiloxane structure and method of making SHIN-ETSU CHEMICAL CO., LTD. (JP) 2010-11-16 US disclosed
EP-1645560-B1 Monofunctional monomer having cage oligosiloxane structure and method of making SHINETSU CHEMICAL CO (JP) 2008-05-28 EP disclosed
EP-1645560-A1 Monofunctional monomer having cage oligosiloxane structure and method of making Shin-Etsu Chemical Co., Ltd. (JP) 2006-04-12 EP disclosed
US-20060074213-A1 Monofunctional monomer having cage oligosiloxane structure and method of making SHIN-ETSU CHEMICAL CO., LTD. (JP) 2006-04-06 US disclosed