SCHEMBL234086

SCHEMBL234086

C=C(C)C(=O)OCCC(O[SiH3])(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
APEX1 P27695 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
THRB P10828 1/20 0.38
TSHR P16473 4/20 0.37
ELANE P08246 1/20 0.36
SCN1A P35498 3/20 0.34
SCN2A Q99250 3/20 0.34
SCN3A Q9NY46 3/20 0.34
LMNA P02545 2/20 0.34
CYP1A2 P05177 2/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2D6 P10635 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
NFKB1 P19838 1/20 0.34
MTOR P42345 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
SCHEMBL15404816 0.92 TDP1 (0.45) POLBAPEX1HTTTDP1THRB
SCHEMBL238398 0.85 ELANE (0.38) POLBAPEX1HTTTDP1THRB
SCHEMBL28552216 0.82 POLB (0.44) POLBAPEX1HTTTDP1THRB
SCHEMBL7872447 0.80 TDP1 (0.44) POLBAPEX1HTTTDP1THRB
SCHEMBL13801023 0.79 POLB (0.43) POLBAPEX1HTTTDP1THRB
SCHEMBL238595 0.78 THRB (0.51) HTTTHRBTSHRSCN1ASCN2A
SCHEMBL22711060 0.77 THRB (0.45) POLBAPEX1HTTTDP1THRB
SCHEMBL3101729 0.77 TDP1 (0.47) POLBAPEX1HTTTDP1THRB
SCHEMBL17320926 0.77 TDP1 (0.49) POLBAPEX1HTTTDP1THRB
Hydrochloric Acid SCHEMBL27613881 0.76 POLB (0.40) POLBAPEX1HTTTDP1THRB

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-9745406-B2 Curable composition CEMEDINE CO., LTD. (JP) 2017-08-29 US disclosed
EP-2412756-B1 CURABLE COMPOSITION CEMEDINE CO LTD (JP) 2016-12-21 EP disclosed
EP-2412756-A1 CURABLE COMPOSITION CEMEDINE CO., LTD. (JP) 2012-02-01 EP disclosed
US-20120004371-A1 CURABLE COMPOSITION CEMEDINE CO., LTD. (JP) 2012-01-05 US disclosed