SCHEMBL9157682

SCHEMBL9157682

COc1c(O)[c]cc(O)c1OC

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
CYP3A4 P08684 2/20 0.34
MAPT P10636 1/20 0.34
PDE4B Q07343 3/20 0.33
PDE4A P27815 2/20 0.33
PDE4C Q08493 2/20 0.33
PDE4D Q08499 2/20 0.33
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
TPMT P51580 1/20 0.31
CCNB2 O95067 1/20 0.30
CDK1 P06493 1/20 0.30
CCNB1 P14635 1/20 0.30
CCNB3 Q8WWL7 1/20 0.30
TP53 P04637 1/20 0.30
TSHR P16473 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
SCHEMBL1466344 0.79 MAPT (0.43) TDP1CYP3A4MAPTCA1CA2
SCHEMBL2919054 0.72 TDP1 (0.52) TDP1CYP3A4MAPTPDE4BPDE4A
SCHEMBL28644340 0.70 TDP1 (0.39) TDP1CYP3A4MAPTPDE4BPDE4A
SCHEMBL29403778 0.68 TDP1 (0.52) TDP1CYP3A4MAPTPDE4BPDE4A
SCHEMBL69925 0.68 TDP1 (0.52) TDP1CYP3A4MAPTPDE4BPDE4A
SCHEMBL1192886 0.67 CA2 (0.43) TDP1CYP3A4MAPTCA1CA2
SCHEMBL5475365 0.65 TDP1 (0.39) TDP1CYP3A4MAPTPDE4BPDE4A
SCHEMBL1299477 0.65 MAPT (0.43) TDP1CYP3A4MAPTCA1CA2
SCHEMBL16056542 0.65 CYP3A4 (0.48) TDP1CYP3A4MAPTCA1CA2
SCHEMBL20476840 0.64 TPMT (0.43) TDP1CYP3A4MAPTPDE4BPDE4A

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
EP-0526302-B1 Depigmentation composition containing derivatives of (2,5-dihydroxyphenyl)-carboxylica OREAL (FR) 1995-03-01 EP claimed
EP-0526302-A1 Depigmentation composition containing derivatives of (2,5-dihydroxyphenyl)-carboxylica L'OREAL (FR) 1993-02-03 EP claimed
EP-0526302-B1 Depigmentation composition containing derivatives of (2,5-dihydroxyphenyl)-carboxylica OREAL (FR) 1995-03-01 EP disclosed
EP-0526302-A1 Depigmentation composition containing derivatives of (2,5-dihydroxyphenyl)-carboxylica L'OREAL (FR) 1993-02-03 EP disclosed