SCHEMBL16492425

SCHEMBL16492425

CN(C)CCC[Si](CCCN(C)C)(OCCN(C)C)OCCN(C)C

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
TSHR P16473 1/20 0.39
DNM1 Q05193 3/20 0.33
KDM4E B2RXH2 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRM3 P20309 1/20 0.32
CHRNA4 P43681 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
HRH3 Q9Y5N1 2/20 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
SCHEMBL16492353 0.86
SCHEMBL16492369 0.84
SCHEMBL17937808 0.83 DNM1 (0.38) ALDH1A1TSHRDNM1KDM4ESMN1; SMN2
SCHEMBL17937740 0.83 DNM1 (0.43) ALDH1A1TSHRDNM1KDM4ESMN1; SMN2
SCHEMBL17937772 0.83 DNM1 (0.43) ALDH1A1TSHRDNM1KDM4ESMN1; SMN2
SCHEMBL17937852 0.81 DNM1 (0.41) ALDH1A1TSHRDNM1KDM4ESMN1; SMN2
SCHEMBL9949302 0.79 ALDH1A1 (0.38) ALDH1A1TSHRDNM1KDM4ESMN1; SMN2
SCHEMBL9950227 0.79 ALDH1A1 (0.38) ALDH1A1TSHRDNM1KDM4ESMN1; SMN2
SCHEMBL17937653 0.79 DNM1 (0.38) ALDH1A1TSHRDNM1KDM4ESMN1; SMN2
SCHEMBL17937856 0.77 DNM1 (0.41) ALDH1A1TSHRDNM1KDM4ESMN1; SMN2

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-8962745-B2 Functionalized polymers and vulcanizates with reduced hysteretic loss BRIDGESTONE CORPORATION (JP) 2015-02-24 US claimed
US-8962745-B2 Functionalized polymers and vulcanizates with reduced hysteretic loss BRIDGESTONE CORPORATION (JP) 2015-02-24 US disclosed