SCHEMBL3239473

SCHEMBL3239473

COc1cc2ncnc(Nc3cccc(C(C)=O)c3)c2cc1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EGFR P00533 7/20 0.65
MAPK14 Q16539 2/20 0.65
LRRK2 Q5S007 4/20 0.61
RET P07949 3/20 0.61
ABCG2 Q9UNQ0 3/20 0.59
SRC P12931 1/20 0.57
KDR P35968 4/20 0.57
FGFR1 P11362 1/20 0.57
FLT1 P17948 1/20 0.57
CDK2 P24941 1/20 0.57
PIK3R1 P27986 1/20 0.57
EPHB2 P29323 1/20 0.57
KIF5B P33176 1/20 0.57
TTBK1 Q5TCY1 1/20 0.57
ABCB1 P08183 2/20 0.56
AURKA O14965 1/20 0.56
AURKB Q96GD4 1/20 0.56
LCK P06239 2/20 0.56
NOD1 Q9Y239 1/20 0.56

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
SCHEMBL5485308 0.88 EGFR (0.77) EGFRMAPK14RETABCG2SRC
Hydrochloric Acid SCHEMBL5471735 0.87 EGFR (0.75) EGFRMAPK14RETABCG2SRC
SCHEMBL3238360 0.87 KDR (0.74) EGFRMAPK14LRRK2RETABCG2
SCHEMBL3531488 0.85 AURKB (0.80) EGFRMAPK14KDRAURKAAURKB
SCHEMBL3238919 0.84 EGFR (0.70) EGFRMAPK14RETABCG2SRC
Hydrochloric Acid SCHEMBL3238911 0.83 EGFR (0.68) EGFRMAPK14RETABCG2SRC
SCHEMBL3239025 0.81 EGFR (0.66) EGFRMAPK14RETABCG2SRC
SCHEMBL17940152 0.81 EGFR (0.70) EGFRMAPK14RETABCG2SRC
SCHEMBL3240732 0.80 EGFR (0.77) EGFRKDRAURKAAURKB
SCHEMBL3238867 0.80 EGFR (0.77) EGFRKDRAURKAAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1369418-B1 QUINAZOLINE DERIVATIVES MITSUBISHI TANABE PHARMA CORP (JP) 2010-07-28 EP disclosed
US-20070265260-A1 Quinazoline derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-11-15 US disclosed
US-20070265260-A1 Quinazoline derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-11-15 US disclosed
US-20070265260-A1 Quinazoline derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-11-15 US disclosed
US-7294629-B2 Quinazoline derivatives MITSUBISHI PHARMA CORPORATION (JP) 2007-11-13 US disclosed
US-7294629-B2 Quinazoline derivatives MITSUBISHI PHARMA CORPORATION (JP) 2007-11-13 US disclosed
US-7294629-B2 Quinazoline derivatives MITSUBISHI PHARMA CORPORATION (JP) 2007-11-13 US disclosed
US-20040116422-A1 Quinazoline derivatives MITSUBISHI PHARMA CORPORATION (JP) 2004-06-17 US disclosed
EP-1369418-A1 QUINAZOLINE DERIVATIVES Mitsubishi Pharma Corporation (JP) 2003-12-10 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-20070265260-A1 Quinazoline derivatives TYK2, ROR1, JAK1 EGFR 1535/4885MAPK14 47/4885LRRK2 647/4885

“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.