SCHEMBL5207731

SCHEMBL5207731

Cc1ccc2cc(C(=O)O)c(Nc3cccc(Cl)c3)nc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
CSNK2A1 P68400 10/20 0.52
CSNK2A2 P19784 9/20 0.52
CSNK2B P67870 9/20 0.52
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
PIM1 P11309 4/20 0.47
PIM2 Q9P1W9 4/20 0.47
AKR1C3 P42330 2/20 0.46
AKR1C2 P52895 2/20 0.46
FADS1 O60427 1/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
GFER P55789 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CHEK1 O14757 1/20 0.46
GAK O14976 1/20 0.46
DAPK3 O43293 1/20 0.46
DYRK3 O43781 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
SCHEMBL5204702 0.96 CSNK2A1 (0.48) ALDH1A1CSNK2A1CSNK2A2CSNK2BMEN1
SCHEMBL5204584 0.90 CSNK2A1 (0.56) CSNK2A1CSNK2A2CSNK2BMEN1KMT2A
SCHEMBL4503390 0.87 PIM1 (0.55) CSNK2A1CSNK2A2CSNK2BMEN1KMT2A
SCHEMBL5204744 0.85 CSNK2A1 (0.49) CSNK2A1CSNK2A2CSNK2BMEN1KMT2A
SCHEMBL5207437 0.85 MEN1 (0.64) ALDH1A1CSNK2A1CSNK2A2CSNK2BMEN1
SCHEMBL5202883 0.85 CSNK2A1 (0.49) CSNK2A1CSNK2A2CSNK2BMEN1KMT2A
SCHEMBL5202960 0.85 CSNK2A1 (0.61) CSNK2A1CSNK2A2CSNK2BMEN1KMT2A
SCHEMBL5203205 0.82 FADS1 (0.53) ALDH1A1CSNK2A1CSNK2A2CSNK2BMEN1
SCHEMBL4489487 0.81 EGFR (0.61) ALDH1A1CSNK2A1CSNK2A2CSNK2BMEN1
SCHEMBL5202876 0.79 AKR1C3 (0.62) ALDH1A1CSNK2A1CSNK2A2CSNK2BMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1372654-A4 QUINOLINE INHIBITORS OF HYAK1 AND HYAK3 KINASES SMITHKLINE BEECHAM CORP (US) 2007-10-03 EP claimed
US-7087758-B2 Quinoline inhibitors of hyaki and hyak3 kinases SMITHKLINE BEECHAM CORPORATION (US) 2006-08-08 US claimed
US-20050043352-A1 Quinoline inhibitors of hyaki and hyak3 kinases SMITHKLINE BEECHAM CORPORATION 2005-02-24 US claimed
EP-1372654-A2 QUINOLINE INHIBITORS OF HYAK1 AND HYAK3 KINASES SmithKline Beecham Corporation (US) 2004-01-02 EP claimed
WO-2002081728-A2 QUINOLINE INHIBITORS OF HYAK1 AND HYAK3 KINASES SMITHKLINE BEECHAM CORPORATION (US) 2002-10-17 WO claimed
EP-1372654-A4 QUINOLINE INHIBITORS OF HYAK1 AND HYAK3 KINASES SMITHKLINE BEECHAM CORP (US) 2007-10-03 EP disclosed
US-7087758-B2 Quinoline inhibitors of hyaki and hyak3 kinases SMITHKLINE BEECHAM CORPORATION (US) 2006-08-08 US disclosed
US-20050043352-A1 Quinoline inhibitors of hyaki and hyak3 kinases SMITHKLINE BEECHAM CORPORATION 2005-02-24 US disclosed
EP-1372654-A2 QUINOLINE INHIBITORS OF HYAK1 AND HYAK3 KINASES SmithKline Beecham Corporation (US) 2004-01-02 EP disclosed
WO-2002081728-A2 QUINOLINE INHIBITORS OF HYAK1 AND HYAK3 KINASES SMITHKLINE BEECHAM CORPORATION (US) 2002-10-17 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-20050043352-A1 Quinoline inhibitors of hyaki and hyak3 kinases HIPK3, HIPK1, HYPK ALDH1A1 3983/4885CSNK2A1 131/4885CSNK2A2 154/4885

“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.