SCHEMBL5468596

SCHEMBL5468596

CCOC(=O)c1cc(C)c2ncc(C(N)=O)c(Nc3cccc(C)c3)c2c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 1/20 0.56
TP53 P04637 3/20 0.52
PDE4B Q07343 3/20 0.52
MAPT P10636 6/20 0.51
THRB P10828 2/20 0.51
AURKB Q96GD4 2/20 0.50
GAA P10253 1/20 0.49
AURKA O14965 1/20 0.49
CREBBP Q92793 1/20 0.49
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
PKM P14618 1/20 0.48

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
SCHEMBL5808384 0.91 TP53 (0.57) TP53PDE4BMAPTTHRBAURKB
SCHEMBL5474414 0.89 MAPT (0.56) TP53PDE4BMAPTTHRBCREBBP
SCHEMBL5462959 0.88 TP53 (0.51) TP53PDE4BMAPTTHRBGAA
SCHEMBL8303878 0.87 CSF1R (0.58) CSF1RPDE4BAURKB
Ammonia Solution, Strong SCHEMBL5455420 0.86 CSF1R (0.57) CSF1RPDE4BAURKB
SCHEMBL12115508 0.80 PDE4B (0.55) CSF1RPDE4BMAPTAURKB
SCHEMBL5823998 0.78 SYK (0.50) MAPTAURKBKDM4ESMN1; SMN2
SCHEMBL11248309 0.77 MAPT (0.80) TP53PDE4BMAPTTHRBAURKB
SCHEMBL13754028 0.76 PDE4B (0.73) CSF1RPDE4B
SCHEMBL5464747 0.76 SLC2A1 (0.56) TP53MAPTTHRBALDH1A1RXFP1

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 6 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 disclosed
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
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
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 CSF1R 3981/4885TP53 4495/4885PDE4B 1/4885

“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.