SCHEMBL6792594

SCHEMBL6792594

COc1cc2ncnc(Nc3ccc(F)c(N)c3)c2cc1OC

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 17/20 0.74
KDR P35968 8/20 0.74
RET P07949 5/20 0.74
FBP1 P09467 3/20 0.74
CLK1 P49759 2/20 0.74
KIF5B P33176 2/20 0.74
RIPK2 O43353 2/20 0.74
AURKA O14965 1/20 0.74
ERBB2 P04626 1/20 0.74
INSR P06213 1/20 0.74
PDGFRB P09619 1/20 0.74
FLT4 P35916 1/20 0.74
EPHB4 P54760 1/20 0.74
TEK Q02763 1/20 0.74
AURKB Q96GD4 1/20 0.74
NOD1 Q9Y239 1/20 0.74
ABCG2 Q9UNQ0 1/20 0.70
LCK P06239 4/20 0.69
FLT1 P17948 1/20 0.67
GAK O14976 1/20 0.64

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
SCHEMBL1483638 0.90 EGFR (0.71) EGFRKDRRETFBP1CLK1
SCHEMBL6783334 0.86 KDR (0.74) EGFRKDRRETCLK1KIF5B
SCHEMBL6787016 0.85 KDR (0.74) EGFRKDRRETFBP1CLK1
SCHEMBL30505605 0.85 EGFR (1.00) EGFRKDRFBP1CLK1AURKA
SCHEMBL2099106 0.85 EGFR (1.00) EGFRKDRFBP1CLK1AURKA
SCHEMBL12846249 0.85 EGFR (0.64) EGFRKDRRETFBP1CLK1
SCHEMBL3533221 0.84 EGFR (0.80) EGFRKDRRETCLK1KIF5B
Hydrochloric Acid SCHEMBL27887194 0.84 EGFR (0.98) EGFRKDRFBP1CLK1AURKA
SCHEMBL26876 0.84 EGFR (0.83) EGFRKDRFBP1CLK1AURKA
SCHEMBL29362232 0.84 EGFR (0.83) EGFRKDRFBP1CLK1AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1158266-C Chemical compounds 2004-07-21 CN disclosed
US-6716847-B2 ANTIALLERGENS, ANTIINFLAMMATORY ASTRAZENECA AB (SE) 2004-04-06 US disclosed
US-20030216417-A1 Substituted anilino-quinoline compounds and use thereof ASTRAZENECA AB 2003-11-20 US disclosed
US-6593333-B1 Processes for their preparation, pharmaceutical compositions containing them and their use in the treatment of diseases or medical conditions mediated by cytokines. Tumour Necrosis Factor (hereinafter TNF), for example TNF alpha , and various ASTRAZENECA AB (SE) 2003-07-15 US disclosed
EP-1117653-B1 QUINOLINE AND QUINAZOLINE DERIVATIVES AND THEIR USE AS INHIBITORS OF CYTOKINE MEDIATED DISEASES ASTRAZENECA AB (SE) 2003-02-05 EP disclosed
CN-1321151-A Chemical compounds ASTRAZENECA AB (SE) 2001-11-07 CN disclosed
EP-1117653-A1 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2001-07-25 EP disclosed
WO-2000020402-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2000-04-13 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-20030216417-A1 Substituted anilino-quinoline compounds and use thereof IL6, IL6ST, IL1A EGFR 1141/4885KDR 1414/4885RET 3317/4885

“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.