SCHEMBL28308652

SCHEMBL28308652

C[Si](C)(C)c1ccc(-c2ccc(-c3ccc([Si](C)(C)C)cc3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.44
NR1H3 Q13133 1/20 0.44
SCN5A Q14524 1/20 0.44
PTAFR P25105 1/20 0.33
ESR1 P03372 3/20 0.32
KIF11 P52732 2/20 0.32
ESR2 Q92731 2/20 0.32
MAPT P10636 2/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 1/20 0.32
ACHE P22303 1/20 0.31
ENPP3 O14638 1/20 0.31
ENPP1 P22413 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HPGD P15428 1/20 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
SCHEMBL10997473 1.00 NR1H2 (0.44) NR1H2NR1H3SCN5APTAFRESR1
SCHEMBL14553136 0.91 ESR1 (0.41) NR1H2NR1H3SCN5APTAFRESR1
SCHEMBL586534 0.89 NR1H2 (0.50) NR1H2NR1H3SCN5AESR1ESR2
SCHEMBL13664879 0.88 ENPP3 (0.45) NR1H2NR1H3SCN5ATDP1LMNA
SCHEMBL9003887 0.88 ALDH1A1 (0.50) ESR1KIF11ESR2MAPTALDH1A1
SCHEMBL12367284 0.88 ENPP3 (0.45) NR1H2NR1H3SCN5ATDP1LMNA
SCHEMBL24037832 0.86 SCN5A (0.38) NR1H2NR1H3SCN5A
SCHEMBL4874529 0.86 ALDH1A1 (0.48) NR1H2NR1H3SCN5AALDH1A1LMNA
SCHEMBL13385395 0.86 ESR1 (0.58) NR1H2NR1H3ESR1KIF11ESR2
SCHEMBL19785207 0.86 ALDH1A1 (0.58) NR1H2NR1H3SCN5AKIF11MAPT

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-106478968-B A kind of preparation method of nanometer of Kapton 陕西科技大学 2019-06-28 CN claimed
CN-106478968-B A kind of preparation method of nanometer of Kapton 陕西科技大学 2019-06-28 CN disclosed