SCHEMBL5515873

SCHEMBL5515873

O=C(O)C(CCCOc1ccccn1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.45
GRM2 Q14416 1/20 0.44
PSMB5 P28074 1/20 0.43
PTPRA P18433 1/20 0.42
SLC1A5 Q15758 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TSHR P16473 2/20 0.40
LTB4R Q15722 2/20 0.39
LMNA P02545 1/20 0.39
NAPRT Q6XQN6 1/20 0.39
P4HTM Q9NXG6 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
PPIA P62937 1/20 0.39

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
SCHEMBL5520189 0.92 PSMB5 (0.44) GRM2PSMB5PTPRASLC1A5NPC1
SCHEMBL5516649 0.81 PTPRA (0.46) PSMB5PTPRASLC1A5NPC1RAB9A
SCHEMBL31370117 0.81 SLC1A5 (0.55) GRM2PSMB5PTPRASLC1A5NPC1
SCHEMBL5515476 0.79 LTB4R (0.54) SMN1; SMN2LTB4RALDH1A1
SCHEMBL28341249 0.78 GRM2 (0.45) GRM2NPC1RAB9ASMN1; SMN2TSHR
SCHEMBL5522710 0.78 LTB4R (0.55) SMN1; SMN2LTB4RALDH1A1
SCHEMBL5517724 0.77 LMNA (0.50) PSMB5NPC1RAB9ASMN1; SMN2TSHR
SCHEMBL7449953 0.77 GRM2 (0.47) GRM2NPC1RAB9ASMN1; SMN2TSHR
SCHEMBL5523873 0.77 TDP1 (0.70) TDP1TSHRL3MBTL1ALDH1A1
SCHEMBL4190714 0.75 KDM4E (0.50) TDP1NPC1RAB9ASMN1; SMN2TSHR

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