SCHEMBL18067625

SCHEMBL18067625

CCCN1C[C@H](C2c3ccccc3CCc3ccccc32)n2ncc(=O)c(OC(=O)C(C)C)c2C1=O

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ NPBWR1 P48145 1/20 0.32
▸ ALDH1A1 P00352 5/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ HTT P42858 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ MAPK10 P53779 1/20 0.30
▸ MTNR1A P48039 2/20 0.30
▸ MTNR1B P49286 2/20 0.30
▸ LMNA P02545 1/20 0.30
▸ PARP1 P09874 1/20 0.30
▸ PARP2 Q9UGN5 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
SCHEMBL18067526 1.00 L3MBTL1 (0.32) L3MBTL1NPBWR1ALDH1A1MEN1KMT2A
SCHEMBL18067514 0.93 NPBWR1 (0.33) NPBWR1ALDH1A1MTNR1AMTNR1B
SCHEMBL18067629 0.93 NPBWR1 (0.33) NPBWR1ALDH1A1MTNR1AMTNR1B
SCHEMBL18067529 0.91 L3MBTL1 (0.33) L3MBTL1NPBWR1ALDH1A1HTTKDM4E
SCHEMBL18067623 0.91 L3MBTL1 (0.33) L3MBTL1NPBWR1ALDH1A1HTTKDM4E
SCHEMBL16559294 0.89 XIAP (0.34) NPBWR1MEN1KMT2A
SCHEMBL16559350 0.89 XIAP (0.34) NPBWR1MEN1KMT2A
SCHEMBL18067628 0.86 NPBWR1 (0.33) NPBWR1MEN1KMT2ATSHR
SCHEMBL18067848 0.84 — —
SCHEMBL18067627 0.83 NPBWR1 (0.34) L3MBTL1NPBWR1ALDH1A1MTNR1AMTNR1B

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
US-10208045-B2 Aza-pyridone compounds and uses thereof ALIOS BIOPHARMA, INC. (US) 2019-02-19 — — US disclosed
WO-2016145103-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF ALIOS BIOPHARMA, INC. (US) 2016-09-15 — — WO disclosed
US-20160264581-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF Janssen Pharmaceuticals, Inc. 2016-09-15 — — 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 (2 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-10208045-B2 Aza-pyridone compounds and uses thereof PNPO, ITPA, PDXK L3MBTL1 4081/4885NPBWR1 3037/4885ALDH1A1 1441/4885
US-20160264581-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF PNPO, ITPA, PDXK L3MBTL1 4081/4885NPBWR1 3037/4885ALDH1A1 1441/4885

“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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