SCHEMBL5260952

SCHEMBL5260952

COc1cc2nc(Nc3cc(C)[nH]n3)nc(Nc3ccc(-c4nc5ccccc5s4)cc3)c2cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AURKA O14965 11/20 1.00
SRC P12931 5/20 1.00
INSR P06213 4/20 1.00
IGF1R P08069 4/20 1.00
EPHB4 P54760 2/20 1.00
EGFR P00533 11/20 0.85
KDR P35968 9/20 0.85
TEK Q02763 5/20 0.85
FLT4 P35916 4/20 0.85
PDGFRB P09619 3/20 0.85
AURKB Q96GD4 10/20 0.62
ERBB2 P04626 2/20 0.51
GSK3B P49841 1/20 0.51
SLC2A1 P11166 1/20 0.50
ABCG2 Q9UNQ0 1/20 0.47

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
SCHEMBL5262588 0.92 AURKA (1.00) AURKASRCINSRIGF1REPHB4
SCHEMBL5260575 0.85 INSR (1.00) AURKASRCINSRIGF1REPHB4
SCHEMBL5256953 0.77 EGFR (1.00) AURKASRCINSRIGF1REPHB4
SCHEMBL5263878 0.76 INSR (0.82) AURKASRCINSRIGF1REPHB4
SCHEMBL5260098 0.75 AURKA (1.00) AURKASRCINSRIGF1REPHB4
SCHEMBL5262114 0.74 AURKA (1.00) AURKASRCINSRIGF1REPHB4
SCHEMBL14621122 0.72 EGFR (0.66) AURKASRCINSRIGF1REPHB4
SCHEMBL5260400 0.70 EGFR (0.85) AURKASRCINSRIGF1REPHB4
SCHEMBL12430723 0.70 AURKA (0.69) AURKASRCINSRIGF1REPHB4
SCHEMBL14602748 0.70 AURKA (1.00) AURKASRCINSRIGF1REPHB4

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
WO-2007009524-A1 2-ARYLBENZOTHIAZOLES AND USES THEREOF 4SC AG (DE) 2007-01-25 WO disclosed
US-20070021446-A1 2-arylbenzothiazole analogues and uses thereof 4SC AG (DE) 2007-01-25 US disclosed
US-20070021446-A1 2-arylbenzothiazole analogues and uses thereof 4SC AG (DE) 2007-01-25 US disclosed
EP-1746096-A1 2-Arylbenzothiazole analogues and uses thereof in the treatment of cancer 4SC AG (DE) 2007-01-24 EP disclosed
EP-1746096-A1 2-Arylbenzothiazole analogues and uses thereof in the treatment of cancer 4SC AG (DE) 2007-01-24 EP 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-20070021446-A1 2-arylbenzothiazole analogues and uses thereof NR2E1, NR2E3, NR0B2 AURKA 493/4885SRC 382/4885INSR 481/4885

“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.