SCHEMBL8144161

SCHEMBL8144161

C=C(C)C(=O)OCCCc1ccc(C(=O)O)c(C(=O)O)c1CCCOC(=O)C(=C)C

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
APEX1 P27695 1/20 0.46
HTT P42858 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
TSHR P16473 3/20 0.40
THRB P10828 1/20 0.38
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
PPARA Q07869 2/20 0.32
PPARG P37231 1/20 0.32
PRKCG P05129 1/20 0.31
PRKCB P05771 1/20 0.31
PRKCA P17252 1/20 0.31
PRKCE Q02156 1/20 0.31
PRKCD Q05655 1/20 0.31

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
SCHEMBL11341100 0.95 POLB (0.50) POLBAPEX1HTTTDP1TSHR
SCHEMBL8144949 0.90 POLB (0.46) POLBAPEX1HTTTDP1TSHR
SCHEMBL2237265 0.90 POLB (0.42) POLBAPEX1HTTTDP1TSHR
SCHEMBL27703062 0.87 POLB (0.46) POLBAPEX1HTTTDP1TSHR
SCHEMBL5523401 0.87 POLB (0.51) POLBAPEX1HTTTDP1TSHR
SCHEMBL29991282 0.87 POLB (0.51) POLBAPEX1HTTTDP1TSHR
SCHEMBL2157174 0.86 POLB (0.40) POLBAPEX1HTTTDP1TSHR
SCHEMBL3861873 0.86 POLB (0.40) POLBAPEX1HTTTDP1TSHR
SCHEMBL8150612 0.85 TDP1 (0.54) POLBAPEX1HTTTDP1TSHR
SCHEMBL5442445 0.83 POLB (0.47) POLBAPEX1HTTTDP1TSHR

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
US-6086794-A LIGHT TRANSMITTING MEDIUM AS WAVEGUIDE AND OPTICAL ELEMENT MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 2000-07-11 US disclosed