SCHEMBL5405232

SCHEMBL5405232

CC(=O)N1CCN(C(=O)c2cc(C)c3ncc(C(N)=O)c(Nc4cccc5c4CCO5)c3c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 5/20 0.54
CSF1R P07333 6/20 0.38
SYK P43405 2/20 0.37
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
MTNR1B P49286 1/20 0.36
JAK2 O60674 1/20 0.36
JAK3 P52333 1/20 0.36
MAP3K11 Q16584 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
SCHEMBL5457430 0.93 PDE4B (0.55) PDE4BCSF1RCYP3A4CYP2C9
SCHEMBL5404792 0.89 PDE4B (0.51) PDE4BCSF1RCYP3A4CYP2C9MTNR1B
SCHEMBL5413089 0.88 PDE4B (0.49) PDE4BCSF1RCYP3A4CYP2C9
SCHEMBL5399007 0.88 PDE4B (0.53) PDE4BCSF1RMTNR1B
SCHEMBL4625981 0.86 PDE4B (0.59) PDE4BCSF1RCYP3A4MTNR1BJAK2
SCHEMBL5763422 0.85 PDE4B (0.57) PDE4BCSF1RMTNR1B
SCHEMBL8312156 0.84 PDE4B (0.57) PDE4BCSF1RMTNR1BJAK2JAK3
Hydrochloric Acid SCHEMBL4264207 0.83 PDE4B (0.57) PDE4BCSF1RMTNR1BJAK2JAK3
SCHEMBL31020770 0.83 PDE4B (0.61) PDE4BCSF1RMTNR1B
SCHEMBL4625986 0.82 PDE4B (0.55) PDE4BCSF1RSYKMTNR1BJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070191426-A1 Derivatives of 3-aminocarbonylquinoline, pharmaceutical compositions containing them and processes and intermediates for their preparation GLAXO GROUP LIMITED (GB) 2007-08-16 US claimed
JP-2007506717-A 2007-03-22 JP claimed
EP-1673345-A1 DERIVATIVES OF 3-AMINOCARBONYLQUINOLINE, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES AND INTERMEDIATES FOR THEIR PREPARATION GLAXO GROUP LIMITED (GB) 2006-06-28 EP claimed
WO-2005030725-A1 DERIVATIVES OF 3-AMINOCARBONYLQUINOLINE, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES AND INTERMEDIATES FOR THEIR PREPARATION GLAXO GROUP LIMITED (GB) 2005-04-07 WO claimed
US-20070191426-A1 Derivatives of 3-aminocarbonylquinoline, pharmaceutical compositions containing them and processes and intermediates for their preparation GLAXO GROUP LIMITED (GB) 2007-08-16 US disclosed
EP-1673345-A1 DERIVATIVES OF 3-AMINOCARBONYLQUINOLINE, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES AND INTERMEDIATES FOR THEIR PREPARATION GLAXO GROUP LIMITED (GB) 2006-06-28 EP disclosed
WO-2005030725-A1 DERIVATIVES OF 3-AMINOCARBONYLQUINOLINE, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES AND INTERMEDIATES FOR THEIR PREPARATION GLAXO GROUP LIMITED (GB) 2005-04-07 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-20070191426-A1 Derivatives of 3-aminocarbonylquinoline, pharmaceutical compositions containing them and processes and intermediates for their preparation PDE4B, PDE4A, PDE3B PDE4B 1/4885CSF1R 3981/4885SYK 1285/4885

“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.