SCHEMBL6090154

SCHEMBL6090154

COC(=O)C1CN(C(=O)OCc2ccccc2)CC2C/C=C\CC(NC(=O)OC(C)(C)C)CN21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.46
CASP1 P29466 3/20 0.43
CASP8 Q14790 3/20 0.43
CASP3 P42574 2/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HTT P42858 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CTSL P07711 1/20 0.39
RORC P51449 2/20 0.38
MITF O75030 1/20 0.38
MAPT P10636 1/20 0.38
KLK5 Q9Y337 1/20 0.37
CHRM4 P08173 1/20 0.37
DPP4 P27487 2/20 0.36
DPP7 Q9UHL4 2/20 0.36
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36

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
SCHEMBL6089693 1.00 PDE4B (0.46) PDE4BCASP1CASP8CASP3KMT2A
SCHEMBL2821598 0.81 PDE4B (0.54) PDE4BKMT2AL3MBTL1HTTNPC1
SCHEMBL22234346 0.80 KMT2A (0.52) PDE4BKMT2AL3MBTL1HTTNPC1
SCHEMBL1722459 0.80 PDE4B (0.51) PDE4BKMT2AL3MBTL1HTTNPC1
SCHEMBL13456796 0.79 KMT2A (0.55) PDE4BKMT2AL3MBTL1HTTNPC1
SCHEMBL14428325 0.79 KMT2A (0.55) PDE4BKMT2AL3MBTL1HTTNPC1
SCHEMBL12164621 0.78 MMP2 (0.49) PDE4BKMT2AL3MBTL1HTTCTSL
SCHEMBL21520375 0.78 MMP2 (0.49) PDE4BKMT2AL3MBTL1HTTCTSL
SCHEMBL8830957 0.78 MMP2 (0.49) PDE4BKMT2AL3MBTL1HTTCTSL
SCHEMBL21520377 0.78 MMP2 (0.49) PDE4BKMT2AL3MBTL1HTTCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7138395-B2 Interleukin-1β converting enzyme inhibitors THE PROCTER & GAMBLE COMPANY (US) 2006-11-21 US disclosed
US-20040014753-A1 Novel interleukin-1beta converting enzyme inhibitors THE PROCTER & GAMBLE COMPANY 2004-01-22 US 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-20040014753-A1 Novel interleukin-1beta converting enzyme inhibitors IL1B, IL1RN, IL1R1 PDE4B 2776/4885CASP1 41/4885CASP8 1129/4885

“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.