SCHEMBL28308668

SCHEMBL28308668

O=C(O)c1ccc(Oc2ccc(C3C4CC5CC(C4)C(c4ccc(Oc6ccc(C(=O)O)c(C(=O)O)c6)cc4)C3C5)cc2)cc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.47
ALDH1A1 P00352 1/20 0.39
HPSE Q9Y251 1/20 0.39
TDP1 Q9NUW8 4/20 0.39
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
APEX1 P27695 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
PYGL P06737 4/20 0.36
MCL1 Q07820 2/20 0.36
GALK1 P51570 1/20 0.36
CASP6 P55212 1/20 0.36
PLEC Q15149 1/20 0.36
PYGM P11217 4/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
DUSP3 P51452 1/20 0.33
PTPN5 P54829 1/20 0.33
PTPN11 Q06124 1/20 0.33
MAPK1 P28482 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
SCHEMBL2708194 0.79 POLB (0.39) POLBALDH1A1HPSETDP1LMNA
SCHEMBL28308622 0.78 POLB (0.56) POLBALDH1A1HPSETDP1LMNA
SCHEMBL2708804 0.78 POLB (0.39) POLBALDH1A1HPSEPYGLPYGM
SCHEMBL28078771 0.77 POLB (0.44) POLBALDH1A1HPSETDP1LMNA
SCHEMBL145176 0.75 POLB (0.73) POLBALDH1A1HPSETDP1LMNA
SCHEMBL30901880 0.75 POLB (0.73) POLBALDH1A1HPSETDP1LMNA
SCHEMBL262311 0.75 POLB (0.73) POLBALDH1A1HPSETDP1LMNA
SCHEMBL30553345 0.75 POLB (0.73) POLBALDH1A1HPSETDP1LMNA
SCHEMBL29406842 0.75 POLB (0.73) POLBALDH1A1HPSETDP1LMNA
SCHEMBL23210656 0.74 PARP10 (0.49) POLBALDH1A1TDP1LMNAL3MBTL1

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
CN-106478968-B A kind of preparation method of nanometer of Kapton 陕西科技大学 2019-06-28 CN claimed