SCHEMBL5509441

SCHEMBL5509441

O=C(O)CCCCCCOc1ccccc1NCC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
ALDH1A1 P00352 1/20 0.48
LTB4R Q15722 1/20 0.46
LTB4R2 Q9NPC1 1/20 0.46
PPARA Q07869 3/20 0.46
CYP2C19 P33261 1/20 0.46
LMNA P02545 1/20 0.45
FABP4 P15090 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HIF1A Q16665 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HDAC1 Q13547 2/20 0.43
HDAC2 Q92769 2/20 0.43
CNR2 P34972 1/20 0.43
FABP3 P05413 1/20 0.43
MAPT P10636 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
HDAC3 O15379 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
SCHEMBL5515782 0.88 ALDH1A1 (0.54) THRBTDP1ALDH1A1LTB4RLTB4R2
SCHEMBL5524144 0.88 ALDH1A1 (0.54) THRBTDP1ALDH1A1LTB4RLTB4R2
SCHEMBL19034905 0.88 TDP1 (0.61) THRBTDP1ALDH1A1CYP2C19LMNA
SCHEMBL9417499 0.87 PTPN1 (0.54) THRBTDP1ALDH1A1LMNAMEN1
SCHEMBL5513638 0.87 ALDH1A1 (0.52) THRBTDP1ALDH1A1LTB4RLTB4R2
SCHEMBL8159475 0.82 CYP2C19 (0.63) PPARACYP2C19MEN1KMT2AHDAC1
SCHEMBL8158931 0.82 CYP2C19 (0.63) PPARACYP2C19MEN1KMT2AHDAC1
SCHEMBL8163696 0.82 CYP2C19 (0.63) PPARACYP2C19MEN1KMT2AHDAC1
SCHEMBL8158211 0.82 CYP2C19 (0.63) PPARACYP2C19MEN1KMT2AHDAC1
SCHEMBL8158347 0.82 CYP2C19 (0.63) PPARACYP2C19MEN1KMT2AHDAC1

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