SCHEMBL9640927

SCHEMBL9640927

CC(O)CC(O)CC(O)C1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.48
KDM4E B2RXH2 2/20 0.47
GMNN O75496 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
BLM P54132 1/20 0.47
PMP22 Q01453 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SHBG P04278 1/20 0.37
EPHX1 P07099 3/20 0.34
HTT P42858 1/20 0.32
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
MMP2 P08253 2/20 0.31
CA9 Q16790 2/20 0.31

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
SCHEMBL2732081 0.89 TP53 (0.54) TP53KDM4EGMNNLMNAMAPT
SCHEMBL28957247 0.82 TP53 (0.44) TP53KDM4EGMNNLMNAMAPT
SCHEMBL9896547 0.80 TP53 (0.54) TP53KDM4EGMNNLMNAMAPT
SCHEMBL12879212 0.80 TP53 (0.54) TP53KDM4EGMNNLMNAMAPT
SCHEMBL11890361 0.78 TP53 (0.50) TP53KDM4EGMNNLMNAMAPT
SCHEMBL11890360 0.78 TP53 (0.50) TP53KDM4EGMNNLMNAMAPT
SCHEMBL8390073 0.78 TP53 (0.47) TP53KDM4EGMNNLMNAMAPT
SCHEMBL26986871 0.76 TP53 (0.43) TP53KDM4EGMNNLMNAMAPT
SCHEMBL14006052 0.72 CTSK (0.37) KDM4E
SCHEMBL9579830 0.72 TP53 (0.40) TP53KDM4EGMNNLMNAMAPT

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-5098929-A Insecticides, insect attractants, fungicides or oxidase inhibitors THE WELLCOME FOUNDATION LIMITED (GB) 1992-03-24 US disclosed