SCHEMBL5513638

SCHEMBL5513638

O=C(O)CCCCNc1ccccc1OCCCCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
HIF1A Q16665 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
PPARA Q07869 3/20 0.47
CYP2C19 P33261 1/20 0.47
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
LMNA P02545 1/20 0.46
THRB P10828 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
LTB4R Q15722 1/20 0.44
LTB4R2 Q9NPC1 1/20 0.44
CHRM2 P08172 1/20 0.44
CNR2 P34972 1/20 0.44
LTA4H P09960 1/20 0.44
CDC25A P30304 1/20 0.44
CDC25B P30305 1/20 0.44
FABP3 P05413 1/20 0.43

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
SCHEMBL5515782 0.98 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AHIF1ANPSR1
SCHEMBL5524144 0.98 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AHIF1ANPSR1
SCHEMBL5514739 0.92 MEN1 (0.52) ALDH1A1MEN1KMT2AHIF1ANPSR1
SCHEMBL5509441 0.87 THRB (0.50) ALDH1A1MEN1KMT2AHIF1ANPSR1
SCHEMBL5515496 0.84 ALDH1A1 (0.57) ALDH1A1MEN1KMT2AHIF1ANPSR1
SCHEMBL5656607 0.84 CHRM2 (0.66) ALDH1A1MEN1KMT2ALMNACHRM2
SCHEMBL3197597 0.82 NPSR1 (0.59) ALDH1A1MEN1KMT2AHIF1ANPSR1
SCHEMBL8163696 0.81 CYP2C19 (0.63) MEN1KMT2APPARACYP2C19
SCHEMBL8158211 0.81 CYP2C19 (0.63) MEN1KMT2APPARACYP2C19
SCHEMBL8158347 0.81 CYP2C19 (0.63) MEN1KMT2APPARACYP2C19

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