SCHEMBL7866043

SCHEMBL7866043

O=CC(=O)c1cccc2cc3ccccc3cc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.62
KDM4E B2RXH2 5/20 0.62
GAA P10253 2/20 0.62
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
HPGD P15428 3/20 0.41
CYP1A2 P05177 2/20 0.41
HSD17B10 Q99714 2/20 0.41
NR4A1 P22736 1/20 0.41
NR4A2 P43354 1/20 0.41
NR4A3 Q92570 1/20 0.41
GLA P06280 1/20 0.41
CYP2C19 P33261 1/20 0.41
MAPK1 P28482 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
PLK1 P53350 1/20 0.41
PTPN1 P18031 2/20 0.40
MTNR1A P48039 1/20 0.40
MAOB P27338 1/20 0.39
GPR52 Q9Y2T5 1/20 0.39

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
SCHEMBL3553966 0.84 KDM4E (0.61) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL1192932 0.82 NR4A1 (0.61) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL29884133 0.82 NR4A1 (0.61) ALDH1A1KDM4EGAAMEN1KMT2A
Water SCHEMBL28515047 0.81 NR4A1 (0.59) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL578683 0.80 KDM4E (0.71) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL9449388 0.80 ALDH1A1 (0.56) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL29405887 0.79 ALDH1A1 (0.69) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL29196640 0.79 KDM4E (0.69) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL123193 0.79 ALDH1A1 (0.69) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL26093 0.79 KDM4E (0.69) ALDH1A1KDM4EGAAMEN1KMT2A

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
CN-103657631-A Catalyst and method for producing carboxylic acid and/or carboxylic anhydride in the presence of the catalyst MITSUBISHI GAS CHEMICAL CO 2014-03-26 CN disclosed
CN-101632925-B Catalyst and process for producing carboxylic acid and/or carboxylic acid anhydride using the same MITSUBISHI GAS CHEMICAL CO 2014-02-26 CN disclosed
CN-101632925-A Catalyst and process for producing carboxylic acid and/or carboxylic acid anhydride using the same MITSUBISHI GAS CHEMICAL CO 2010-01-27 CN disclosed
US-6300306-B1 TREATING HARD SURFACES, POLYOXYALKYLENE UNITS AND SULFONATEDPOLYAMIDES AND SULFONATED POLYFUNCTIONAL UNITS AND BINDING GROUPS WITH ESTER RHODIA CHIMIE (FR) 2001-10-09 US disclosed