SCHEMBL2747131

SCHEMBL2747131

COc1cc2ncnc(Nc3ccc4c(C(=O)Nc5ccccc5)cccc4c3)c2cc1OC

nearest known ligand 0.74

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 13/20 0.74
▸ EGFR P00533 4/20 0.69
▸ MAPK14 Q16539 1/20 0.69
▸ AURKB Q96GD4 4/20 0.69
▸ AURKA O14965 2/20 0.69
▸ RET P07949 1/20 0.61

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
SCHEMBL2747187 0.93 KDR (0.71) KDREGFRMAPK14AURKBAURKA
SCHEMBL2747980 0.91 EGFR (0.68) KDREGFRMAPK14
SCHEMBL2746015 0.89 KDR (0.62) KDREGFRMAPK14AURKBAURKA
SCHEMBL2746962 0.87 KDR (0.62) KDREGFRMAPK14RET
SCHEMBL5753165 0.86 KDR (0.58) KDREGFRMAPK14AURKBAURKA
SCHEMBL2747392 0.85 KDR (0.69) KDREGFRMAPK14AURKBAURKA
SCHEMBL4549037 0.85 KDR (0.69) KDREGFRMAPK14AURKBAURKA
Hydrochloric Acid SCHEMBL8310307 0.84 KDR (0.80) KDREGFRMAPK14AURKBAURKA
SCHEMBL4821285 0.84 BRAF (0.71) KDREGFRMAPK14
SCHEMBL8933899 0.83 AURKB (0.94) KDREGFRMAPK14AURKBAURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8178557-B2 Compounds and methods of use AMGEN INC. (US) 2012-05-15 — — US disclosed
US-8178557-B2 Compounds and methods of use AMGEN INC. (US) 2012-05-15 — — US disclosed
US-8178557-B2 Compounds and methods of use AMGEN INC. (US) 2012-05-15 — — US disclosed
US-20090176774-A1 Compounds and methods of use AMGEN INC. (US) 2009-07-09 — — US disclosed
US-20090176774-A1 Compounds and methods of use AMGEN INC. (US) 2009-07-09 — — US disclosed
US-20090176774-A1 Compounds and methods of use AMGEN INC. (US) 2009-07-09 — — US disclosed
US-7435823-B2 Compounds and methods of use AMGEN INC. (US) 2008-10-14 — — US disclosed
US-7435823-B2 Compounds and methods of use AMGEN INC. (US) 2008-10-14 — — US disclosed
US-7435823-B2 Compounds and methods of use AMGEN INC. (US) 2008-10-14 — — US disclosed
EP-1720836-A1 6-SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-BENZO [D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2006-11-15 — — EP disclosed
US-20060241115-A1 Compounds and methods of use AMGEN INC. 2006-10-26 — — US disclosed
EP-1713484-A2 COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2006-10-25 — — EP disclosed
WO-2005082859-A1 6-SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2005-09-09 — — WO disclosed
WO-2005070891-A2 COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2005-08-04 — — 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 (2 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-20060241115-A1 Compounds and methods of use HGF, HGFAC, MET KDR 354/4885EGFR 129/4885MAPK14 1944/4885
US-20090176774-A1 Compounds and methods of use HGF, HGFAC, MET KDR 354/4885EGFR 129/4885MAPK14 1944/4885

“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.

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