SCHEMBL5808384

SCHEMBL5808384

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

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.57
MAPT P10636 5/20 0.53
KDM4E B2RXH2 2/20 0.52
ALDH1A1 P00352 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
RXFP1 Q9HBX9 1/20 0.52
CREBBP Q92793 1/20 0.51
PDE4B Q07343 3/20 0.51
PKM P14618 1/20 0.51
ALOX15 P16050 1/20 0.49
THRB P10828 2/20 0.47
AURKA O14965 1/20 0.46
AURKB Q96GD4 1/20 0.46

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
SCHEMBL5468596 0.91 CSF1R (0.56) TP53MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL5474414 0.87 MAPT (0.56) TP53MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL5462959 0.86 TP53 (0.51) TP53MAPTALDH1A1PDE4BTHRB
SCHEMBL5808379 0.79 ALOX15 (0.52) TP53MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL5325876 0.79 TP53 (0.81) TP53MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL8303878 0.77 CSF1R (0.58) PDE4BAURKB
SCHEMBL1276099 0.77 PDE4B (0.84) TP53PDE4B
SCHEMBL2723683 0.77 KDM4E (0.59) TP53MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL2723375 0.77 KDM4E (0.59) TP53MAPTKDM4EALDH1A1SMN1; SMN2
Ammonia Solution, Strong SCHEMBL5455420 0.77 CSF1R (0.57) PDE4BAURKB

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
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 TP53 4495/4885MAPT 3241/4885KDM4E 260/4885

“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.