SCHEMBL3747823

SCHEMBL3747823

O=C1OC(=O)c2cc(C[SiH](Cl)Cl)ccc21

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPK1 P28482 2/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TYMS P04818 2/20 0.33
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA7 P43166 2/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
CA4 P22748 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL4547146 0.79 ALOX15 (0.46) ALOX15TDP1ALDH1A1MAPK1NPC1
SCHEMBL7599687 0.78 ALOX15 (0.50) ALOX15TDP1ALDH1A1MAPK1NPC1
SCHEMBL434869 0.78 ALOX15 (0.50) ALOX15TDP1ALDH1A1MAPK1NPC1
SCHEMBL3747320 0.77 ALDH1A1 (0.38) ALOX15TDP1ALDH1A1MAPK1NPC1
SCHEMBL3744175 0.75 ALDH1A1 (0.37) ALOX15TDP1ALDH1A1MAPK1NPC1
SCHEMBL4958672 0.75 ALDH1A1 (0.60) ALOX15TDP1ALDH1A1MAPK1NPC1
SCHEMBL20251161 0.75 ALOX15 (0.46) ALOX15TDP1ALDH1A1MAPK1NPC1
SCHEMBL18445782 0.75 ALOX15 (0.46) ALOX15TDP1ALDH1A1MAPK1NPC1
SCHEMBL14511002 0.75 ALOX15 (0.46) ALOX15TDP1ALDH1A1MAPK1NPC1
SCHEMBL19036066 0.75 ALOX15 (0.46) ALOX15TDP1ALDH1A1MAPK1NPC1

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