SCHEMBL236261

SCHEMBL236261

C=C(C)C(=O)OC[Si](OCC)(OCC)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
MAPT P10636 3/20 0.41
THRB P10828 1/20 0.39
ELANE P08246 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TSHR P16473 5/20 0.35
GLA P06280 1/20 0.33
CASP1 P29466 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL238285 0.89 TSHR (0.40) ALDH1A1MAPTTHRBELANEKMT2A
SCHEMBL27863692 0.86 THRB (0.44) ALDH1A1MAPTTHRBELANEKMT2A
SCHEMBL234085 0.85 ALDH1A1 (0.41) ALDH1A1MAPTTHRBELANEKMT2A
SCHEMBL237531 0.85 ELANE (0.39) ALDH1A1MAPTTHRBELANEKMT2A
SCHEMBL2345676 0.83 TSHR (0.44) ALDH1A1MAPTTHRBELANEKMT2A
SCHEMBL27775044 0.83 THRB (0.45) ALDH1A1MAPTTHRBELANEKMT2A
SCHEMBL7527455 0.82 TSHR (0.47) ALDH1A1MAPTTHRBELANEPOLB
SCHEMBL21066753 0.81 TSHR (0.49) ALDH1A1MAPTTHRBPOLBAPEX1
SCHEMBL21066797 0.81 TSHR (0.49) ALDH1A1MAPTTHRBPOLBAPEX1
SCHEMBL3132573 0.81 THRB (0.43) ALDH1A1MAPTTHRBELANEKMT2A

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