SCHEMBL4897534

SCHEMBL4897534

CCCC(=O)OCC(C)OCC(C)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.56
TDP1 Q9NUW8 2/20 0.52
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
DUSP3 P51452 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 2/20 0.40
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
ATM Q13315 1/20 0.39
LPAR6 P43657 1/20 0.36
LPAR1 Q92633 1/20 0.36
LPAR4 Q99677 1/20 0.36
LPAR5 Q9H1C0 1/20 0.36
LPAR2 Q9HBW0 1/20 0.36
LPAR3 Q9UBY5 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ENPP2 Q13822 1/20 0.36
PRKCA P17252 3/20 0.36

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
SCHEMBL8734078 0.98 MAPT (0.54) MAPTTDP1LMNAKDM4EDUSP3
Methoxymethane SCHEMBL19666592 0.96 MAPT (0.53) MAPTTDP1LMNAKDM4EDUSP3
SCHEMBL28758523 0.89 MAPT (0.46) MAPTTDP1LMNAKDM4EDUSP3
SCHEMBL1171517 0.88 MAPT (0.75) MAPTTDP1LMNAKDM4EDUSP3
SCHEMBL10784276 0.86 MAPT (0.78) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL8950262 0.86 MAPT (0.78) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL15665486 0.86 MAPT (0.78) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL17668918 0.86 MAPT (0.78) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL323988 0.86 MAPT (0.78) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL4895593 0.86 MAPT (0.78) MAPTLMNAKDM4EDUSP3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8252371-B2 Injecting a foam support containing corosion resistant material; railroad wagons; one step SOCIETE NATIONALE DES CHEMINS DE FER FRANCAIS (FR) 2012-08-28 US disclosed
US-20080199608-A1 Method for the anticorrosive Treatment of Hollow Bodies, Method for Producing a Metallic Structure Treated According to Said Method, and Method for Maintaining the Structure SOCIETE NATIONALE DES CHEMINS DE FER FRANCAIS (FR) 2008-08-21 US disclosed