SCHEMBL5205311

SCHEMBL5205311

COc1cc(OB(O)O)cc(OC)c1OCCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.35
FKBP1A P62942 1/20 0.33
GAA P10253 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
BRD4 O60885 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
SLC6A5 Q9Y345 1/20 0.31
TNFRSF1A P19438 1/20 0.31
SYK P43405 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
SCHEMBL6339576 0.84 GAA (0.34) MAPK1FKBP1AGAALMNAMAPT
SCHEMBL5203576 0.80 TNFRSF1A (0.45) MAPK1LMNAMAPTL3MBTL1ALDH1A1
SCHEMBL5203599 0.79 MAPK1 (0.36) MAPK1FKBP1AGAASMN1; SMN2SLC6A5
SCHEMBL19438931 0.77 L3MBTL1 (0.47) FKBP1AGAALMNAMAPTL3MBTL1
SCHEMBL5208220 0.77 SMN1; SMN2 (0.48) MAPK1GAAMAPTL3MBTL1ALDH1A1
SCHEMBL20915927 0.76 TSHR (0.48) FKBP1AGAAMAPTL3MBTL1ALDH1A1
SCHEMBL5205549 0.74 HTR2A (0.49) LMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL20605146 0.72 SMN1; SMN2 (0.50) MAPK1FKBP1AGAALMNAMAPT
SCHEMBL5203497 0.72 CYP2C9 (0.35) MAPK1MAPTL3MBTL1ALDH1A1MEN1
SCHEMBL5207796 0.71 CYP3A4 (0.52) MAPTMEN1KMT2A

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
EP-1403251-B1 BIS(2-ARYL-5-PYRIDYL) DERIVATIVE KOWA CO (JP) 2007-07-18 EP disclosed
EP-1403251-A1 BIS(2-ARYL-5-PYRIDYL) DERIVATIVE Kowa Co., Ltd. (JP) 2004-03-31 EP disclosed