SCHEMBL5352876

SCHEMBL5352876

NC(=O)CC[CH]Cc1ccc(OCc2ccccc2)cc1C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 2/20 0.48
PARP10 Q53GL7 5/20 0.48
MAOB P27338 3/20 0.47
PARP15 Q460N3 4/20 0.43
PARP14 Q460N5 1/20 0.43
SPHK2 Q9NRA0 2/20 0.43
SPHK1 Q9NYA1 1/20 0.43
FFAR1 O14842 2/20 0.42
FFAR4 Q5NUL3 1/20 0.41
NR4A2 P43354 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL5358933 0.87 PARP10 (0.51) SIRT2PARP10MAOBPARP15PARP14
SCHEMBL5354497 0.85 SIRT2 (0.46) SIRT2PARP10MAOBNR4A2
SCHEMBL6803013 0.80 SIRT2 (0.49) SIRT2PARP10MAOBPARP15NR4A2
SCHEMBL5355208 0.80 SIRT2 (0.41) SIRT2PARP10MAOBPARP15PARP14
SCHEMBL15709261 0.76 PARP15 (0.60) SIRT2PARP10MAOBPARP15PARP14
SCHEMBL4930554 0.74 PARP10 (0.60) SIRT2PARP10MAOBPARP15SPHK2
SCHEMBL3882956 0.74 MAOB (0.56) PARP10MAOBSPHK2SPHK1FFAR1
SCHEMBL7370244 0.73 SPHK2 (0.47) SIRT2PARP10MAOBSPHK2SPHK1
SCHEMBL7907691 0.73 MAOB (0.73) SIRT2PARP10MAOBPARP15NR4A2
SCHEMBL3454792 0.73 PARP15 (0.62) SIRT2PARP10MAOBPARP15NR4A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7253194-B2 Compounds and inhibitors of phospholipases THE UNIVERSITY OF QUEENSLAND (AU) 2007-08-07 US disclosed
EP-1309552-A4 COMPOUNDS AND INHIBITORS OF PHOSPHOLIPASES UNIV QUEENSLAND (AU) 2005-07-20 EP disclosed
US-20040033995-A1 Compounds and inhibitors of phospholipases QUEENSLAND, THE UNIVERSITY OF (AU) 2004-02-19 US disclosed
EP-1309552-A1 COMPOUNDS AND INHIBITORS OF PHOSPHOLIPASES THE UNIVERSITY OF QUEENSLAND (AU) 2003-05-14 EP disclosed
WO-2002008189-A1 COMPOUNDS AND INHIBITORS OF PHOSPHOLIPASES THE UNIVERSITY OF QUEENSLAND (AU) 2002-01-31 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040033995-A1 Compounds and inhibitors of phospholipases PLA2G4C, PLA2G4B, PLA2G4A SIRT2 4701/4885PARP10 2145/4885MAOB 1169/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.