SCHEMBL9950227

SCHEMBL9950227

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

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
TSHR P16473 1/20 0.38
DNM1 Q05193 3/20 0.32
KDM4E B2RXH2 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRM3 P20309 1/20 0.31
CHRNA4 P43681 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL9948924 0.88
SCHEMBL18108792 0.87 DNM1 (0.39) ALDH1A1TSHRDNM1KDM4ESMN1; SMN2
SCHEMBL17937742 0.85 DNM1 (0.43) ALDH1A1TSHRDNM1KDM4ESMN1; SMN2
SCHEMBL9898104 0.85 MAPT (0.32) CHRNB2CHRNA4
SCHEMBL9949225 0.85
SCHEMBL329402 0.82 ALDH1A1 (0.38) ALDH1A1TSHRDNM1KDM4ESMN1; SMN2
SCHEMBL9949302 0.82 ALDH1A1 (0.38) ALDH1A1TSHRDNM1KDM4ESMN1; SMN2
SCHEMBL16492425 0.79 ALDH1A1 (0.39) ALDH1A1TSHRDNM1KDM4ESMN1; SMN2
SCHEMBL9960424 0.78
Dimethylamine SCHEMBL9950230 0.77 DNM1 (0.30) DNM1

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 4 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-20120165464-A1 FUNCTIONALIZED POLYMERS AND VULCANIZATES WITH REDUCED HYSTERETIC LOSS BRIDGESTONE CORPORATION (JP) 2012-06-28 US claimed
US-8962745-B2 Functionalized polymers and vulcanizates with reduced hysteretic loss BRIDGESTONE CORPORATION (JP) 2015-02-24 US disclosed
US-20120165464-A1 FUNCTIONALIZED POLYMERS AND VULCANIZATES WITH REDUCED HYSTERETIC LOSS BRIDGESTONE CORPORATION (JP) 2012-06-28 US disclosed