SCHEMBL5034183

SCHEMBL5034183

CC[Si](Cl)(c1ccc(C)cc1)c1ccc(C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.40
TDP1 Q9NUW8 1/20 0.40
ESR1 P03372 2/20 0.34
ALDH1A1 P00352 3/20 0.33
IDO1 P14902 1/20 0.33
AR P10275 1/20 0.33
ESR2 Q92731 1/20 0.33
GSK3B P49841 1/20 0.32
MAPT P10636 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP19A1 P11511 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
CYP1A2 P05177 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
SCHEMBL6390896 0.81 ESR1 (0.37) ACHETDP1ESR1ALDH1A1IDO1
SCHEMBL11379067 0.80 ACHE (0.40) ACHETDP1ESR1ALDH1A1IDO1
SCHEMBL5032278 0.80 ACHE (0.40) ACHETDP1ESR1ALDH1A1IDO1
SCHEMBL705504 0.77 TP53 (0.38) ACHEESR1ALDH1A1ESR2GSK3B
SCHEMBL988371 0.76 ACHE (0.47) ACHETDP1ESR1ALDH1A1IDO1
SCHEMBL12817403 0.74 MAPT (0.33) ACHETDP1ALDH1A1MAPTL3MBTL1
SCHEMBL1538600 0.73 ACHE (0.50) ACHETDP1ALDH1A1IDO1CA1
SCHEMBL297883 0.73 ACHE (0.50) ACHETDP1ALDH1A1IDO1CA1
SCHEMBL301896 0.73 ACHE (0.50) ACHETDP1ALDH1A1IDO1CA1
SCHEMBL14407582 0.72 NR1H2 (0.50) ACHETDP1ESR1ALDH1A1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1999167-A2 ZIEGLER-NATTA CATALYST WITH IN SITU-GENERATED DONOR Novolen Technology Holdings, C.V. (NL) 2008-12-10 EP disclosed
WO-2007106348-A2 ZIEGLER-NATTA CATALYST WITH IN SITU-GENERATED DONOR NOVOLEN TECHNOLOGY HOLDINGS C.V. (NL) 2007-09-20 WO disclosed
US-20070213204-A1 Ziegler-Natta catalyst with in situ-generated donor NOVOLEN TECHNOLOGY HOLDINGS C.V. 2007-09-13 US disclosed