SCHEMBL4754339

SCHEMBL4754339

CCC[C@H]1C(=O)OC(=O)[C@@H]1CCC

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KAT2A Q92830 3/20 0.38
PLA2G6 O60733 2/20 0.33
PLA2G4A P47712 1/20 0.33
TP53 P04637 1/20 0.33
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
DAGLA Q9Y4D2 1/20 0.30
PRKCA P17252 1/20 0.30

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
SCHEMBL4754340 1.00 KAT2A (0.38) KAT2APLA2G6PLA2G4ATP53MEN1
SCHEMBL12660142 0.93 KAT2A (0.35) KAT2APLA2G6PLA2G4ATP53MEN1
SCHEMBL8239541 0.93 KAT2A (0.35) KAT2APLA2G6PLA2G4ATP53MEN1
SCHEMBL7130234 0.87 PRKCA (0.41) PLA2G6PLA2G4ATP53MEN1CYP1A2
SCHEMBL13449682 0.87 KAT2A (0.33) KAT2A
SCHEMBL127823 0.85 KAT2A (0.34) KAT2APLA2G6PLA2G4ATP53
SCHEMBL14981010 0.85 KAT2A (0.34) KAT2APLA2G6PLA2G4ATP53
SCHEMBL13449685 0.85 KAT2A (0.34) KAT2APLA2G6PLA2G4ATP53
SCHEMBL19769963 0.85 KAT2A (0.32) KAT2ADAGLA
SCHEMBL31377052 0.83 PRSS1 (0.38) KAT2AALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008155619-A2 PREPARATION OF OPTICALLY-ACTIVE CYCLIC AMINO ACIDS PFIZER INC. (US) 2008-12-24 WO disclosed
EP-1912936-A2 STEREOSELECTIVE SYNTHESIS OF 3,4-DISUBSTITUTED CYCLOPENTANONES AND RELATED COMPOUNDS Pharmacia & Upjohn Company LLC (US) 2008-04-23 EP disclosed
WO-2007010387-A2 STEREOSELECTIVE SYNTHESIS OF 3,4-DISUBSTITUTED CYCLOPENTANONES AND RELATED COMPOUNDS PHARMACIA & UPJOHN COMPANY LLC (US) 2007-01-25 WO disclosed