SCHEMBL6252379

SCHEMBL6252379

O=CC(=O)C1=CC(=O)C=CC1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
TDP1 Q9NUW8 3/20 0.36
RECQL P46063 2/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
ALOX12 P18054 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPK1 P28482 2/20 0.33
NR4A1 P22736 1/20 0.33
ERBB2 P04626 1/20 0.32
MAOA P21397 3/20 0.31
MAOB P27338 3/20 0.31
BCHE P06276 1/20 0.30
POLB P06746 1/20 0.30
ACHE P22303 1/20 0.30
APEX1 P27695 1/20 0.30
CASP1 P29466 1/20 0.30
BLM P54132 1/20 0.30
MDM2 Q00987 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
SCHEMBL28327160 0.75 TDP1 (0.42) ALDH1A1TDP1RECQLMEN1MAPT
SCHEMBL10778388 0.75 ALDH1A1 (0.37) ALDH1A1TDP1RECQLMEN1MAPT
SCHEMBL134429 0.73 ALDH1A1 (0.40) ALDH1A1TDP1RECQLMEN1MAPT
SCHEMBL865959 0.73 ALDH1A1 (0.42) ALDH1A1TDP1RECQLMEN1MAPT
SCHEMBL28198484 0.71 ALDH1A1 (0.41) ALDH1A1TDP1RECQLMEN1MAPT
SCHEMBL1287162 0.71 ERBB2 (0.39) ALDH1A1TDP1RECQLMEN1MAPT
SCHEMBL2257187 0.71 ALDH1A1 (0.44) ALDH1A1TDP1RECQLMEN1MAPT
SCHEMBL26444866 0.70 ALDH1A1 (0.37) ALDH1A1TDP1RECQLMEN1MAPT
Water SCHEMBL28540739 0.70 ERBB2 (0.38) ALDH1A1TDP1RECQLMEN1MAPT
SCHEMBL8049734 0.68 ALDH1A1 (0.36) ALDH1A1TDP1RECQLMEN1MAPT

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-1566169-A1 Cosmetic compositions containing combinations of Bupleurum species extracts and Salvia miltiorrhiza extracts for the treatment and reduction of blemishes caused by cellulite ABOCA S.p.A. (IT) 2005-08-24 EP disclosed