SCHEMBL1551903

SCHEMBL1551903

Nc1ccc(OC(=O)O)cc1OC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 3/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 4/20 0.36
ELANE P08246 3/20 0.36
MEN1 O00255 3/20 0.36
LMNA P02545 1/20 0.36
ACHE P22303 1/20 0.36
NR4A1 P22736 1/20 0.35
GFER P55789 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
TDP1 Q9NUW8 2/20 0.34
USP2 O75604 1/20 0.34
POLB P06746 1/20 0.34
THRB P10828 1/20 0.34
PKM P14618 1/20 0.34
APEX1 P27695 1/20 0.34
RECQL P46063 1/20 0.34

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
SCHEMBL8244593 0.87 ALDH1A1 (0.61) KDM4EALDH1A1CYP3A4MAPTKMT2A
SCHEMBL1552395 0.84 MAPT (0.42) KDM4EALDH1A1CYP3A4MAPTMAPK1
SCHEMBL7759781 0.83 NR4A1 (0.54) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL17735426 0.83 KDM4E (0.50) KDM4EALDH1A1CYP3A4MAPTMAPK1
SCHEMBL28382964 0.82 KDM4E (0.61) KDM4EALDH1A1CYP3A4MAPTMAPK1
SCHEMBL7754586 0.82 MAPT (0.48) KDM4EALDH1A1CYP3A4MAPTMAPK1
SCHEMBL376800 0.82 ALDH1A1 (0.52) KDM4EALDH1A1CYP3A4MAPTMAPK1
SCHEMBL1954453 0.82 ALDH1A1 (0.52) KDM4EALDH1A1CYP3A4MAPTMAPK1
SCHEMBL686585 0.81 KDM4E (0.48) KDM4EALDH1A1CYP3A4MAPTMAPK1
SCHEMBL8722118 0.79 KDM4E (0.47) KDM4ECYP3A4MAPTMAPK1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1994133-A1 COLOUR-PROTECTING LAUNDRY DETERGENT COMPOSITION Henkel AG & Co. KGaA (DE) 2008-11-26 EP claimed
WO-2007104392-A1 COLOUR-PROTECTING LAUNDRY DETERGENT COMPOSITION HENKEL AG & CO. KGAA (DE) 2007-09-20 WO claimed
EP-1994133-B1 COLOUR-PROTECTING LAUNDRY DETERGENT COMPOSITION HENKEL AG & CO KGAA (DE) 2011-04-27 EP disclosed
EP-1994133-A1 COLOUR-PROTECTING LAUNDRY DETERGENT COMPOSITION Henkel AG & Co. KGaA (DE) 2008-11-26 EP disclosed
WO-2007104392-A1 COLOUR-PROTECTING LAUNDRY DETERGENT COMPOSITION HENKEL AG & CO. KGAA (DE) 2007-09-20 WO disclosed