SCHEMBL13936618

SCHEMBL13936618

COc1cc2nccc(Oc3ccc([N+](=O)[O-])cc3F)c2cc1O

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 4/20 0.52
KDR P35968 3/20 0.52
FGFR2 P21802 1/20 0.47
MET P08581 9/20 0.46
AXL P30530 3/20 0.46
SRC P12931 1/20 0.44
TGFBR1 P36897 1/20 0.44
FLT3 P36888 1/20 0.44
MERTK Q12866 1/20 0.44
PDGFRB P09619 1/20 0.44

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
SCHEMBL30697769 0.96 PDGFRA (0.52) PDGFRAKDRFGFR2METAXL
SCHEMBL165288 0.96 PDGFRA (0.52) PDGFRAKDRFGFR2METAXL
SCHEMBL22009936 0.92 PDGFRA (0.56) PDGFRAKDRFGFR2METAXL
SCHEMBL29487188 0.91 PDGFRA (0.59) PDGFRAKDRFGFR2METAXL
SCHEMBL174159 0.91 PDGFRA (0.59) PDGFRAKDRFGFR2METAXL
SCHEMBL25281154 0.88 PDGFRA (0.51) PDGFRAKDRFGFR2METAXL
SCHEMBL22960033 0.87 KDR (0.50) PDGFRAKDRFGFR2METAXL
SCHEMBL29487138 0.87 KDR (0.50) PDGFRAKDRFGFR2METAXL
SCHEMBL1133098 0.87 AXL (0.59) PDGFRAKDRMETAXLSRC
SCHEMBL1133096 0.87 AXL (0.59) PDGFRAKDRMETAXLSRC

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
US-9186318-B2 Quinolyl-containing hydroxamic acid compound and preparation method thereof, and pharmaceutical composition containing this compound and use thereof BEIJING KONRUNS PHARMACEUTICAL CO., LTD (CN) 2015-11-17 US disclosed
US-9186318-B2 Quinolyl-containing hydroxamic acid compound and preparation method thereof, and pharmaceutical composition containing this compound and use thereof BEIJING KONRUNS PHARMACEUTICAL CO., LTD (CN) 2015-11-17 US disclosed
US-8933230-B2 Phosphorus-containing group-substituted quinoline, its preparation process, medical composition containing the compounds and application BEIJING KONRUNS PHARMACEUTICAL CO., LTD. (CN) 2015-01-13 US disclosed
US-8933230-B2 Phosphorus-containing group-substituted quinoline, its preparation process, medical composition containing the compounds and application BEIJING KONRUNS PHARMACEUTICAL CO., LTD. (CN) 2015-01-13 US disclosed
US-20140221425-A1 Quinolyl-containing Hydroxamic Acid Compound and Preparation Method Thereof, and Pharmaceutical Composition Containing This Compound and Use Thereof BEIJING KONRUNS PHARMACEUTICAL CO., LTD. (CN) 2014-08-07 US disclosed
US-20140221425-A1 Quinolyl-containing Hydroxamic Acid Compound and Preparation Method Thereof, and Pharmaceutical Composition Containing This Compound and Use Thereof BEIJING KONRUNS PHARMACEUTICAL CO., LTD. (CN) 2014-08-07 US disclosed
US-7495104-B2 Quinoline or quinazoline derivatives inhibiting auto-phosphorylation of fibroblast growth factor receptors KIRIN BEER KABUSHIKI KAISHA (JP) 2009-02-24 US disclosed
US-20080207617-A1 Quinoline Derivatives and Quinazoline Derivatives Inhibiting Autophosphrylation of Flt3 and Medicinal Compositions Containing the Same KIRIN BEER KABUSHIKI KAISHA (JP) 2008-08-28 US 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-20140221425-A1 Quinolyl-containing Hydroxamic Acid Compound and Preparation Method Thereof, and Pharmaceutical Composition Containing This Compound and Use Thereof HDAC5, HDAC1, HDAC7 PDGFRA 2530/4885KDR 3893/4885FGFR2 1772/4885
US-20080207617-A1 Quinoline Derivatives and Quinazoline Derivatives Inhibiting Autophosphrylation of Flt3 and Medicinal Compositions Containing the Same FLT3, TYRO3, ABL1 PDGFRA 229/4885KDR 148/4885FGFR2 1020/4885

“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.