SCHEMBL5598560

SCHEMBL5598560

CCCCO[Si](OCCCC)(OCCCC)C(C)(C)OCC1CO1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.51
ALDH1A1 P00352 5/20 0.47
TDP1 Q9NUW8 1/20 0.45
TSHR P16473 4/20 0.37
MAPK1 P28482 1/20 0.37
TP53 P04637 2/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CYP1A2 P05177 1/20 0.34
PPARG P37231 1/20 0.34
HIF1A Q16665 1/20 0.34
ENPP2 Q13822 1/20 0.33
LPAR2 Q9HBW0 1/20 0.33
EPHX1 P07099 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
SCHEMBL5598307 0.90 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL5598344 0.84 SMN1; SMN2 (0.49) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL5598660 0.83 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL5598181 0.83 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL5365502 0.81 SMN1; SMN2 (0.49) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL5365508 0.76 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL5598359 0.75 ALDH1A1 (0.57) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL5598477 0.74 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL19125936 0.74 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL21378207 0.74 SMN1; SMN2 (0.60) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1764398-B1 Hard coat composiiton and optical element ITOH OPTICAL IND (JP) 2015-07-22 EP disclosed
EP-1764398-A1 Hard coat composiiton and optical element Itoh Optical Industrial Co., Ltd. (JP) 2007-03-21 EP disclosed
EP-1273639-B1 OPTICAL ELEMENT ITOH OPTICAL IND (JP) 2006-10-25 EP disclosed
EP-1273639-A1 OPTICAL ELEMENT Itoh Optical Industrial Co., Ltd. (JP) 2003-01-08 EP disclosed