SCHEMBL5574245

SCHEMBL5574245

CCOC(=O)Cc1[nH]c2ccc(O)cc2c1-c1ccc(OC(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.44
ALOX5 P09917 12/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
MAPK10 P53779 1/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 1/20 0.43
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38

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
SCHEMBL5268590 0.83 ALDH1A1 (0.55) GAAALOX5MAPTALDH1A1HPGD
SCHEMBL5573968 0.83 HPGD (0.43) ALOX5MAPTALDH1A1HPGDKDM4E
SCHEMBL5266671 0.78 POLB (0.41) GAAALOX5MAPTALDH1A1HPGD
SCHEMBL5268810 0.77 MAPT (0.52) GAAALOX5MAPTALDH1A1HPGD
SCHEMBL5573956 0.76 PKM (0.44) GAAALOX5MAPTALDH1A1HPGD
SCHEMBL5270537 0.72 ALDH1A1 (0.54) GAAMAPTALDH1A1HPGDKDM4E
SCHEMBL5516043 0.71 POLB (0.43) GAAMAPTALDH1A1HPGDKDM4E
SCHEMBL27549077 0.71 NR1I2 (0.60) GAAALOX5MAPTALDH1A1HPGD
SCHEMBL1193860 0.70 GAA (0.48) GAAALOX5MAPTALDH1A1HPGD
SCHEMBL14404161 0.70 ALOX5 (0.48) GAAALOX5MAPTALDH1A1HPGD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1841736-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-10-10 EP disclosed
WO-2006077367-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMATION BIOLIPOX AB (SE) 2006-07-27 WO disclosed