SCHEMBL8467168

SCHEMBL8467168

CCC1=C([Si](C)(C)NC(=O)c2ccccc2)CC=C1.[LiH].[LiH]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.35
NAAA Q02083 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
RAB9A P51151 4/20 0.34
KDM4E B2RXH2 3/20 0.34
NPSR1 Q6W5P4 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 3/20 0.33
HDAC1 Q13547 2/20 0.33
HDAC6 Q9UBN7 2/20 0.33
NPC1 O15118 2/20 0.33
HDAC3 O15379 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
IDO1 P14902 1/20 0.33
ALOX15 P16050 1/20 0.33
CA9 Q16790 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
SCHEMBL8467480 0.73 HDAC3 (0.38) GAAL3MBTL1RAB9AKDM4EMEN1
SCHEMBL8674456 0.70 ALDH1A1 (0.36) GAAL3MBTL1RAB9AKDM4EMEN1
SCHEMBL8675774 0.70 NPC1 (0.38) GAAL3MBTL1RAB9AKDM4EMEN1
SCHEMBL3658195 0.67 GAA (0.48) GAANAAAL3MBTL1RAB9AKDM4E
SCHEMBL7938016 0.66 HDAC3 (0.54) GAAL3MBTL1RAB9AKDM4EMEN1
SCHEMBL451924 0.66 HDAC3 (0.54) GAAL3MBTL1RAB9AKDM4EMEN1
SCHEMBL10336633 0.64 SMN1; SMN2 (0.46) GAANAAAL3MBTL1RAB9AKDM4E
SCHEMBL15065492 0.63 SMN1; SMN2 (0.45) GAANAAAL3MBTL1RAB9AKDM4E
SCHEMBL28641832 0.62 HDAC3 (0.58) GAARAB9AKDM4EMEN1KMT2A
SCHEMBL28987869 0.61 SMN1; SMN2 (0.46) GAANAAAL3MBTL1RAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0750625-B1 PREPARATION OF MONOCYCLOPENTADIENYL METAL COMPLEXES BY NUCLEOPHILIC SUBSTITUTION OF BIS(CYCLOPENTADIENYL) METAL COMPLEXES DOW CHEMICAL CO (US) 1999-02-03 EP disclosed
US-5659054-A Preparation of monocyclopentadienyl metal complexes by nucleophilic substitution of bis(cyclopentadienyl) metal complexes THE DOW CHEMICAL COMPANY (US) 1997-08-19 US disclosed
EP-0750625-A1 PREPARATION OF MONOCYCLOPENTADIENYL METAL COMPLEXES BY NUCLEOPHILIC SUBSTITUTION OF BIS(CYCLOPENTADIENYL) METAL COMPLEXES THE DOW CHEMICAL COMPANY (US) 1997-01-02 EP disclosed
US-5504224-A Preparation of monocyclopentadienyl metal complexes by nucleophilic substitution of bis(cyclopentadienyl) metal complexes THE DOW CHEMICAL COMPANY (US) 1996-04-02 US disclosed
WO-1995025112-A1 PREPARATION OF MONOCYCLOPENTADIENYL METAL COMPLEXES BY NUCLEOPHILIC SUBSTITUTION OF BIS(CYCLOPENTADIENYL) METAL COMPLEXES THE DOW CHEMICAL COMPANY (US) 1995-09-21 WO disclosed