SCHEMBL9756895

SCHEMBL9756895

CCCC(=O)OC[C@H](C)CO

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
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
MAPT P10636 1/20 0.47
PRKCA P17252 4/20 0.46
PRKCE Q02156 2/20 0.46
PRKCQ Q04759 2/20 0.46
PRKCD Q05655 2/20 0.46
ALDH1A1 P00352 2/20 0.44
TSHR P16473 2/20 0.42
CYP3A4 P08684 1/20 0.42
ATM Q13315 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
DGKA P23743 1/20 0.41
FAAH O00519 2/20 0.40

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
SCHEMBL2251000 1.00 LMNA (0.49) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL9756867 0.89 MAPT (0.52) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL14430649 0.89 LMNA (0.44) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL9756780 0.88 LMNA (0.59) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL9756779 0.88 LMNA (0.59) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL4391090 0.85 LMNA (0.55) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL985280 0.85 MAPT (0.48) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL21143376 0.85 LMNA (0.50) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL29473913 0.85 MAPT (0.48) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL23188411 0.85 LMNA (0.70) LMNAKDM4EDUSP3MEN1KMT2A

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
EP-0316374-B1 OPTICALLY ACTIVE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 1991-07-31 EP claimed