SCHEMBL3400467

SCHEMBL3400467

CCOC(=O)CC(=O)c1cc(N(C)C)nc(N(C)C)n1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ CTSA P10619 1/20 0.43
▸ KMT2A Q03164 4/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ LMNA P02545 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ MGAM O43451 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ SI P14410 1/20 0.38
▸ MGAM2 Q2M2H8 1/20 0.38
▸ TSHR P16473 1/20 0.36
▸ MIF P14174 1/20 0.36
▸ NAPEPLD Q6IQ20 1/20 0.35
▸ CTSK P43235 1/20 0.34

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
SCHEMBL3405792 0.76 HTT (0.43) ALDH1A1SMN1; SMN2CTSAKMT2AMEN1
SCHEMBL11507939 0.74 GAA (0.40) ALDH1A1SMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL29740323 0.72 CTSA (0.46) ALDH1A1SMN1; SMN2CTSAKMT2AMEN1
SCHEMBL13692143 0.72 CTSA (0.43) ALDH1A1SMN1; SMN2CTSAKMT2AMEN1
SCHEMBL13689297 0.68 CTSA (0.43) ALDH1A1SMN1; SMN2CTSAKMT2AMEN1
SCHEMBL23149714 0.68 KMT2A (0.43) ALDH1A1SMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL30786543 0.68 KMT2A (0.43) ALDH1A1SMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL3825010 0.67 NPC1 (0.53) ALDH1A1SMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL11622169 0.66 KDM4E (0.59) ALDH1A1SMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL3943579 0.66 P2RX7 (0.54) ALDH1A1SMN1; SMN2KMT2AMEN1KDM4E

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
EP-2158199-B1 PIPERIDINE COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2010-11-17 — — EP disclosed
EP-2158199-B1 PIPERIDINE COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2010-11-17 — — EP disclosed
WO-2008152418-A1 PIPERIDINE COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2008-12-18 — — WO disclosed
US-20080312255-A1 PIPERDINE COMPOUNDS AND USES THEREOF-911 ASTRAZENECA AB (SE) 2008-12-18 — — US disclosed
US-20080312255-A1 PIPERDINE COMPOUNDS AND USES THEREOF-911 ASTRAZENECA AB (SE) 2008-12-18 — — 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-20080312255-A1 PIPERDINE COMPOUNDS AND USES THEREOF-911 NISCH, PIR, QDPR ALDH1A1 243/4885SMN1; SMN2 2282/4885CTSA 2256/4885

“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.

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