SCHEMBL2367809

SCHEMBL2367809

C=C(C)C(=O)OCCC[Si](O[Si](CCCOC(=O)C(=C)C)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.47
POLB P06746 1/20 0.47
APEX1 P27695 1/20 0.47
HTT P42858 1/20 0.47
TSHR P16473 5/20 0.44
THRB P10828 1/20 0.38
ELANE P08246 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
L3MBTL1 Q9Y468 3/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 2/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL13863120 0.93 TDP1 (0.44) TDP1POLBAPEX1HTTTSHR
SCHEMBL26282496 0.93 TDP1 (0.44) TDP1POLBAPEX1HTTTSHR
SCHEMBL17123278 0.93 TDP1 (0.44) TDP1POLBAPEX1HTTTSHR
SCHEMBL13488578 0.93 TDP1 (0.44) TDP1POLBAPEX1HTTTSHR
SCHEMBL15404813 0.90 TDP1 (0.46) TDP1POLBAPEX1HTTTSHR
SCHEMBL26282526 0.89 TDP1 (0.41) TDP1POLBAPEX1HTTTSHR
SCHEMBL28054471 0.88 TSHR (0.44) TDP1POLBAPEX1HTTTSHR
SCHEMBL26282531 0.88 TDP1 (0.40) TDP1POLBAPEX1HTTTSHR
SCHEMBL19718601 0.86 POLB (0.39) TDP1POLBAPEX1HTTTSHR
SCHEMBL10629482 0.85 TDP1 (0.49) TDP1POLBAPEX1HTTTSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8288496-B2 Contact lens and its manufacturing method NIPPON CONTACT LENS INC. (JP) 2012-10-16 US disclosed
US-20110237701-A1 CONTACT LENS AND ITS MANUFACTURING METHOD NIPPON CONTACT LENS INC. (JP) 2011-09-29 US disclosed
EP-2369370-A2 Contact lens and its manufacturing method Nippon Contact Lens Inc. (JP) 2011-09-28 EP disclosed