SCHEMBL28292333

SCHEMBL28292333

CCC(CCCOCC1CO1)[SiH2]OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.49
ALDH1A1 P00352 3/20 0.46
TDP1 Q9NUW8 1/20 0.46
TSHR P16473 2/20 0.46
MAPK1 P28482 1/20 0.39
PDK1 Q15118 1/20 0.34

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
SCHEMBL15609790 0.77 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL28185574 0.76 ALDH1A1 (0.38) ALDH1A1TSHRMAPK1
SCHEMBL6008186 0.75 SMN1; SMN2 (0.57) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL10452902 0.74 ALDH1A1 (0.65) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL829789 0.73 TSHR (0.55) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL27521802 0.72 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL25543463 0.72 TSHR (0.63) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL29273366 0.72 TSHR (0.53) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL10585663 0.70 TSHR (0.65) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL16390481 0.70 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1

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
CN-105744965-B Antithrombotic medical devices and methods 柯惠有限合伙公司 2019-07-09 CN claimed
CN-109715424-A Composite vehicle door assembly formed from sheet molded composite resin transfer molding assembly 康廷南拓结构塑料有限公司 2019-05-03 CN disclosed