SCHEMBL5804065

SCHEMBL5804065

CCCCCCCCCCCCCCCC(=O)OCC(C)CCCCCC

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.69
LMNA P02545 4/20 0.62
ALDH1A1 P00352 1/20 0.62
KDM4E B2RXH2 1/20 0.60
DUSP3 P51452 1/20 0.60
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
DGKA P23743 1/20 0.58
CYP3A4 P08684 1/20 0.57
TSHR P16473 1/20 0.57
ATM Q13315 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
PRKCA P17252 3/20 0.57
PRKCE Q02156 1/20 0.57
PRKCQ Q04759 1/20 0.57
PRKCD Q05655 1/20 0.57
PAM P19021 2/20 0.53

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
SCHEMBL6339166 1.00 MAPT (0.69) MAPTLMNAALDH1A1KDM4EDUSP3
SCHEMBL28097507 1.00 MAPT (0.69) MAPTLMNAALDH1A1KDM4EDUSP3
SCHEMBL27712600 1.00 MAPT (0.69) MAPTLMNAALDH1A1KDM4EDUSP3
SCHEMBL6333627 1.00 MAPT (0.69) MAPTLMNAALDH1A1KDM4EDUSP3
SCHEMBL7684641 1.00 MAPT (0.69) MAPTLMNAALDH1A1KDM4EDUSP3
SCHEMBL6333568 1.00 MAPT (0.69) MAPTLMNAALDH1A1KDM4EDUSP3
SCHEMBL27629048 1.00 MAPT (0.69) MAPTLMNAALDH1A1KDM4EDUSP3
SCHEMBL2342373 0.98 MAPT (0.66) MAPTLMNAALDH1A1KDM4EDUSP3
SCHEMBL4624621 0.96 MAPT (0.69) MAPTLMNAALDH1A1KDM4EDUSP3
SCHEMBL4625009 0.96 MAPT (0.69) MAPTLMNAALDH1A1KDM4EDUSP3

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
WO-2006088793-A1 ELASMOBRANCH-REPELLING COMPOUNDS, METHODS OF USE AND DEVICES SHARK DEFENSE LLC (US) 2006-08-24 WO disclosed