SCHEMBL5511458

SCHEMBL5511458

O=C(O)c1ccccc1NCCC(C(=O)O)(C(=O)O)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.63
HSD17B10 Q99714 4/20 0.63
HPGD P15428 4/20 0.63
KDM4E B2RXH2 4/20 0.53
AGTR1 P30556 1/20 0.53
RAB9A P51151 1/20 0.53
L3MBTL1 Q9Y468 3/20 0.50
POLB P06746 1/20 0.50
CTDSP1 Q9GZU7 1/20 0.50
FABP4 P15090 2/20 0.45
KMT2A Q03164 3/20 0.44
GLA P06280 1/20 0.44
CLCN2 P51788 1/20 0.43
CFD P00746 1/20 0.43
PLK1 P53350 1/20 0.43
FABP3 P05413 1/20 0.42
FABP5 Q01469 1/20 0.42
KDM6B O15054 1/20 0.42
KDM4C Q9H3R0 1/20 0.42
MEN1 O00255 2/20 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
SCHEMBL5508912 0.90 ALDH1A1 (0.59) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL5512467 0.89 ALDH1A1 (0.58) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL5523862 0.88 ALDH1A1 (0.56) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL8689214 0.84 ALDH1A1 (0.79) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL10253859 0.83 HPGD (0.63) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL15635830 0.83 ALDH1A1 (0.63) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL5518940 0.83 ALDH1A1 (0.57) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL9279236 0.79 ALDH1A1 (0.71) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL1902821 0.77 HPGD (0.69) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL9809381 0.77 ALDH1A1 (0.69) ALDH1A1HSD17B10HPGDKDM4EAGTR1

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-1470258-B1 COMPOSITION AND ITS USE FOR IMPARTING WATER REPELLENCY TO LEATHER OR FURSKINS, TEXTILES AND OTHER FIBROUS MATERIALS TFL LEDERTECHNIK GMBH (DE) 2013-08-28 EP disclosed
US-7250456-B2 Composition and its use for imparting water repellency to leather or furskins, textiles and other fibrous materials TFL LEDERTECHNIK GMBH (DE) 2007-07-31 US disclosed
US-20050148702-A1 Composition and its use for imparting water repellency to leather or furskins, textiles and other fibrous materials TFL LEDERTECHNIK GMBH (DE) 2005-07-07 US disclosed
EP-1470258-A1 COMPOSITION AND ITS USE FOR IMPARTING WATER REPELLENCY TO LEATHER OR FURSKINS, TEXTILES AND OTHER FIBROUS MATERIALS TFL Ledertechnik GmbH (DE) 2004-10-27 EP disclosed
WO-2003064707-A1 COMPOSITIONS AND ITS USE FOR IMPARTING WATER REPELLENCY TO LEATHER OR FURSKINS, TEXTILES AND OTHER FIBROUS MATERIALS TFL LEDERTECHNIK GMBH (DE) 2003-08-07 WO disclosed