SCHEMBL4336059

SCHEMBL4336059

C=C(C)C(=O)OCCO[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C.C=CC(OC(=O)C(=C)C)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
THRB P10828 2/20 0.32
ELANE P08246 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL4336062 0.81 HCAR2 (0.31) ELANE
SCHEMBL299791 0.80 HPGD (0.42) POLBAPEX1HTTTDP1ELANE
SCHEMBL2028631 0.77 THRB (0.50) POLBAPEX1HTTTDP1THRB
SCHEMBL27082345 0.70 HPGD (0.43) TDP1
SCHEMBL26936566 0.68 HPGD (0.41) POLBAPEX1HTTTDP1ELANE
SCHEMBL18061412 0.68 CHRM1 (0.58) POLBAPEX1HTTTDP1THRB
SCHEMBL18770237 0.68 THRB (0.41) POLBAPEX1HTTTDP1THRB
SCHEMBL24634077 0.68 THRB (0.49) POLBAPEX1HTTTDP1THRB
SCHEMBL7778106 0.68 HPGD (0.37) THRBELANE
SCHEMBL235139 0.68 MTNR1A (0.49) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1928979-B1 FUNCTIONALIZED PHOTOREACTIVE COMPOUNDS ROLIC AG (CH) 2009-03-04 EP disclosed