SCHEMBL4471357

SCHEMBL4471357

Nc1nccc2scc(-c3ccc(F)c(Cl)c3)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHB4 P54760 7/20 1.00
KDR P35968 13/20 0.63
AURKA O14965 3/20 0.63
AURKB Q96GD4 3/20 0.63
ROCK2 O75116 2/20 0.52
RPS6KA5 O75582 2/20 0.52
MAP4K4 O95819 2/20 0.52
LCK P06239 2/20 0.52
LYN P07948 2/20 0.52
RET P07949 2/20 0.52
PIM1 P11309 2/20 0.52
FGFR1 P11362 2/20 0.52
FLT1 P17948 2/20 0.52
RPS6KB1 P23443 2/20 0.52
AXL P30530 2/20 0.52
FLT4 P35916 2/20 0.52
FLT3 P36888 2/20 0.52
FRK P42685 2/20 0.52
CSNK1A1 P48729 2/20 0.52
CSNK1D P48730 2/20 0.52

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
SCHEMBL3525533 0.85 EPHB4 (0.74) EPHB4KDRAURKAAURKBROCK2
SCHEMBL3535182 0.82 KDR (0.76) EPHB4KDRAURKAAURKBROCK2
SCHEMBL31060331 0.78 KDR (1.00) EPHB4KDRAURKAAURKBROCK2
SCHEMBL3531281 0.78 KDR (1.00) EPHB4KDRAURKAAURKBROCK2
SCHEMBL4472583 0.77 EPHB4 (1.00) EPHB4KDRAURKAAURKBROCK2
SCHEMBL28803622 0.76 KDR (0.79) EPHB4KDRAURKAAURKBROCK2
SCHEMBL3533248 0.76 KDR (0.68) EPHB4KDRAURKAAURKBROCK2
SCHEMBL17165793 0.76 KDR (0.77) EPHB4KDRAURKAAURKBROCK2
SCHEMBL3529866 0.75 KDR (0.62) EPHB4KDRAURKAAURKBROCK2
SCHEMBL4474048 0.74 EPHB4 (1.00) EPHB4KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7592352-B2 Substituted thieno and furo-pyridines SMITHKLINE BEECHAM CORPORATION (US) 2009-09-22 US claimed
US-20080182868-A1 Novel chemical compounds SMITHKLINE BEECHAM CORPORATION 2008-07-31 US claimed
JP-2006528685-A 2006-12-21 JP claimed
EP-1620094-A2 NOVEL CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2006-02-01 EP claimed
WO-2004100947-A2 NOVEL CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2004-11-25 WO claimed
US-7592352-B2 Substituted thieno and furo-pyridines SMITHKLINE BEECHAM CORPORATION (US) 2009-09-22 US disclosed
US-7592352-B2 Substituted thieno and furo-pyridines SMITHKLINE BEECHAM CORPORATION (US) 2009-09-22 US disclosed
US-7592352-B2 Substituted thieno and furo-pyridines SMITHKLINE BEECHAM CORPORATION (US) 2009-09-22 US disclosed
US-20080182868-A1 Novel chemical compounds SMITHKLINE BEECHAM CORPORATION 2008-07-31 US disclosed
US-20080182868-A1 Novel chemical compounds SMITHKLINE BEECHAM CORPORATION 2008-07-31 US disclosed
US-20080182868-A1 Novel chemical compounds SMITHKLINE BEECHAM CORPORATION 2008-07-31 US disclosed
EP-1620094-A2 NOVEL CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2006-02-01 EP disclosed
WO-2004100947-A2 NOVEL CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2004-11-25 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-20080182868-A1 Novel chemical compounds HRAS, VHL, TP53 EPHB4 2484/4885KDR 983/4885AURKA 554/4885

“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.