SCHEMBL9348333

SCHEMBL9348333

C=Cc1ccc(CCO[Si](C)(C)C(C)(C)C)cc1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
DUT P33316 2/20 0.34
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA7 P36544 1/20 0.33
CHRNA4 P43681 1/20 0.33
BACE1 P56817 1/20 0.32
PPARA Q07869 2/20 0.32
PPARG P37231 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
SCHEMBL2356225 0.84 ALDH1A1 (0.41) ALDH1A1DUTBACE1PPARAPPARG
SCHEMBL8348643 0.83 ALDH1A1 (0.38) ALDH1A1DUTCHRNB2CHRNB4CHRNA3
SCHEMBL2696466 0.80 CYP1A2 (0.41) DUTPPARA
SCHEMBL14648388 0.79 CHRNA7 (0.49) ALDH1A1DUTCHRNB2CHRNB4CHRNA3
SCHEMBL23066421 0.79 DUT (0.35) DUTPPARA
SCHEMBL2142867 0.79 DUT (0.38) DUT
SCHEMBL16537957 0.79 ALDH1A1 (0.37) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL16537599 0.79 ALDH1A1 (0.37) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL1245973 0.78 ELOVL1 (0.41) DUT
SCHEMBL2366928 0.78 GFER (0.45) ALDH1A1DUT

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-5278244-A Copolymerization using Ziegler-Natta catalysts MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-01-11 US claimed
US-5104952-A Coatings on chromatograhic support; molding materials MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-04-14 US claimed