SCHEMBL5203604

SCHEMBL5203604

COc1ccc2cc(C(=O)O)c(Nc3ccc(OC)c(OC)c3)nc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.49
MAPK9 P45984 1/20 0.49
ABCG2 Q9UNQ0 5/20 0.48
ABCB1 P08183 4/20 0.48
ABCC1 P33527 3/20 0.48
MAPT P10636 4/20 0.47
KMT2A Q03164 3/20 0.47
POLB P06746 3/20 0.47
MEN1 O00255 2/20 0.47
LMNA P02545 1/20 0.47
CTSV O60911 1/20 0.47
CTSL P07711 1/20 0.47
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
KDR P35968 2/20 0.45
AKR1C3 P42330 1/20 0.45
AKR1C2 P52895 1/20 0.45
HTT P42858 2/20 0.45
PKM P14618 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL5207302 0.86 MEN1 (0.50) MAPTKMT2APOLBMEN1LMNA
SCHEMBL4482947 0.85 AKR1C3 (0.58) MAPTKMT2AMEN1LMNAKDM4E
SCHEMBL4472958 0.85 SMN1; SMN2 (0.50) MAPTKMT2APOLBMEN1LMNA
SCHEMBL5207762 0.85 AKR1C3 (0.49) MAPTKMT2APOLBMEN1LMNA
SCHEMBL5202789 0.85 AKR1C3 (0.60) MAPTKMT2APOLBMEN1LMNA
SCHEMBL5208003 0.85 AKR1C3 (0.49) MAPTKMT2APOLBMEN1LMNA
SCHEMBL5208486 0.84 AKR1C3 (0.50) MAPTKMT2AMEN1KDM4EGAA
SCHEMBL5203173 0.83 KDR (0.50) MAPTKMT2APOLBMEN1LMNA
SCHEMBL5205531 0.83 MAPT (0.53) MAPTKMT2APOLBMEN1KDM4E
SCHEMBL4490131 0.83 AKR1C3 (0.47) MAPTKMT2APOLBMEN1LMNA

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 MAPK8 540/4885MAPK9 884/4885ABCG2 1902/4885

“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.