SCHEMBL6765097

SCHEMBL6765097

CCCCCC(=O)OC[C@@H](C)C(O)NC(=O)OCCCC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.55
LMNA P02545 2/20 0.49
KDM4E B2RXH2 1/20 0.49
DUSP3 P51452 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
ALDH1A1 P00352 1/20 0.47
DGKA P23743 2/20 0.46
LPAR6 P43657 1/20 0.44
LPAR1 Q92633 1/20 0.44
LPAR4 Q99677 1/20 0.44
LPAR5 Q9H1C0 1/20 0.44
LPAR2 Q9HBW0 1/20 0.44
LPAR3 Q9UBY5 1/20 0.44
ENPP2 Q13822 1/20 0.44
PRKCA P17252 3/20 0.43
PRKCE Q02156 1/20 0.43
PRKCQ Q04759 1/20 0.43
PRKCD Q05655 1/20 0.43
CYP3A4 P08684 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
SCHEMBL5165590 0.84 MAPT (0.52) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL9153115 0.77 MAPT (0.71) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL9149108 0.76 MAPT (0.74) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL9152072 0.76 MAPT (0.74) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL9149118 0.76 MAPT (0.74) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL9151927 0.76 MAPT (0.74) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL9150524 0.76 MAPT (0.74) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL1866206 0.76 MAPT (0.64) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL6578955 0.75 DGKA (0.54) MAPTLMNAALDH1A1DGKACYP3A4
SCHEMBL11465997 0.74 MAPT (0.61) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6723745-B2 PREVENTION OR TREATMENT OF AUTOIMMUNE DISEASE IN WARM BLOODED ANIMAL SANKYO COMPANY, LIMITED (JP) 2004-04-20 US disclosed