SCHEMBL9186247

SCHEMBL9186247

O=C(CCC1c2cccc(O)c2C(=O)c2c(O)cccc21)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 7/20 0.53
NR4A1 P22736 1/20 0.47
NR4A2 P43354 1/20 0.47
NR4A3 Q92570 1/20 0.47
PLA2G4B P0C869 1/20 0.45
MAOB P27338 1/20 0.45
PARP10 Q53GL7 1/20 0.45
SRD5A2 P31213 1/20 0.44
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
ALOX5 P09917 1/20 0.42
PTGES O14684 1/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
PTGS1 P23219 1/20 0.42

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
SCHEMBL9182657 0.89 EGFR (0.49) EGFRNR4A1NR4A2NR4A3PLA2G4B
SCHEMBL9185432 0.85 L3MBTL1 (0.45) NR4A2ALDH1A1MAPTL3MBTL1ALOX5
SCHEMBL9182611 0.78 L3MBTL1 (0.50) MAPTRAB9AL3MBTL1LMNAHDAC6
SCHEMBL8062854 0.77 FFAR1 (0.54) ALOX5FFAR1FFAR4
SCHEMBL9185267 0.77 L3MBTL1 (0.53) MAPTRAB9AL3MBTL1LMNAHDAC6
SCHEMBL8072697 0.76 ALOX5 (0.47) NR4A1NR4A2NR4A3PLA2G4BMAOB
SCHEMBL9186283 0.72 MAPT (0.49) MAOBALDH1A1MAPTHTTRAB9A
SCHEMBL1557011 0.71 FFAR1 (0.71) EGFRNR4A1NR4A2NR4A3PLA2G4B
SCHEMBL958582 0.71 EGFR (0.69) EGFRNR4A1NR4A2NR4A3PLA2G4B
SCHEMBL6811506 0.71 EGFR (0.69) EGFRNR4A1NR4A2NR4A3PLA2G4B

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-0664780-A1 10-SUBSTITUTED 1,8-DIHYDROXY-9(10H) ANTHRACENONE PHARMACEUTICALS TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 1995-08-02 EP disclosed