SCHEMBL10018792

SCHEMBL10018792

CC(=O)OCCCC[Si](C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
TSHR P16473 3/20 0.41
CHRM5 P08912 2/20 0.41
CHRM1 P11229 2/20 0.41
CHRM3 P20309 2/20 0.41
PGR P06401 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
HTR1A P08908 1/20 0.41
CHRNB2 P17787 1/20 0.41
TBXA2R P21731 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA7 P36544 1/20 0.41
CHRNA4 P43681 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CHRNA10 Q9GZZ6 1/20 0.41
CHRNA9 Q9UGM1 1/20 0.41
LMNA P02545 2/20 0.41
APOBEC3A P31941 1/20 0.41

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
SCHEMBL13006965 0.93 ALDH1A1 (0.56) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL28971514 0.84 ACHE (0.36) ALDH1A1TSHRACHE
SCHEMBL826515 0.83 ALDH1A1 (0.48) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL189930 0.83 ALDH1A1 (0.74) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL15070973 0.81 ALDH1A1 (0.48) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL541869 0.81 ALDH1A1 (0.48) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL5136503 0.80 ALDH1A1 (0.70) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL15299079 0.80 ALDH1A1 (0.70) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL15967828 0.80 ALDH1A1 (0.70) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL11492305 0.80 ALDH1A1 (0.70) ALDH1A1TSHRCHRM5CHRM1CHRM3

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-8093313-B2 Tissue scaffolding composites EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2012-01-10 US disclosed
US-20110097801-A1 TISSUE SCAFFOLDING COMPOSITES CRESTLINE DIRECT FINANCE, L.P. 2011-04-28 US disclosed