SCHEMBL9609152

SCHEMBL9609152

CCCCOc1ccc(NC(=O)C2(C(=O)Nc3ccc(F)cc3)CC2)cc1F

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MET P08581 19/20 0.58
KDR P35968 8/20 0.57
RET P07949 2/20 0.56
KIT P10721 2/20 0.56
FLT3 P36888 2/20 0.56
PDGFRA P16234 1/20 0.56
AXL P30530 3/20 0.56
PDGFRB P09619 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54

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
SCHEMBL4405511 0.86 FAAH (0.66) METKDRRETKITFLT3
SCHEMBL16136597 0.83 MET (0.67) METKDRRETKITFLT3
SCHEMBL4402823 0.82 MET (0.86) METKDRRETKITFLT3
SCHEMBL13615636 0.81 MET (0.59) METKDRRETKITFLT3
SCHEMBL16381016 0.80 MET (0.59) METKDRRETKITFLT3
SCHEMBL26075853 0.80 MET (0.58) METKDRRETKITFLT3
SCHEMBL15580185 0.79 MET (0.51) METKDRRETKITFLT3
SCHEMBL22521226 0.79 HDAC2 (0.84) METKDRRETKITFLT3
SCHEMBL16069961 0.78 MET (0.58) METKDRRETKITFLT3
SCHEMBL12164847 0.77 S1PR4 (0.52) KDR

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
US-20140221372-A1 METHOD OF ADMINISTRATION AND TREATMENT GlaxoSmithKline Intellectual Property (NO 2.) Limited (GB) 2014-08-07 US disclosed
WO-2014093750-A1 METHOD OF ADMINISTRATION AND TREATMENT GLAXOSMITHKLINE LLC (US) 2014-06-19 WO disclosed
US-20130252956-A1 METHODS OF TREATING CANCER EXELIXIS, INC. 2013-09-26 US disclosed
US-20130150363-A1 Method of Treating Cancer Using a cMET and AXL Inhibitor and an ErbB Inhibitor GLAXOSMITHKLINE (US) 2013-06-13 US disclosed
US-20130142790-A1 Method of Treating Cancer Using a cMET and AXL Inhibitor and an ErbB Inhibitor GLAXOSMITHKLINE (US) 2013-06-06 US disclosed
WO-2012071321-A1 METHOD OF TREATING CANCER GLAXOSMITHKLINE LLC (US) 2012-05-31 WO disclosed
EP-2409704-A2 c-Met modulators and methods of use Exelixis Inc. (US) 2012-01-25 EP disclosed
WO-2009137429-A1 METHOD OF TREATING CANCER USING A CMET AND AXL INHIBITOR AND AN ERBB INHIBITOR SMITHKLINE BEECHAM CORPORATION (US) 2009-11-12 WO disclosed
US-20090274693-A1 Method of Treating Cancer using a cMet and AXL Inhibitor and an ErbB Inhibitor EXELIXIS, INC. 2009-11-05 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 (5 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-20130252956-A1 METHODS OF TREATING CANCER HRAS, TP53, HCCS MET 54/4885KDR 3034/4885RET 1428/4885
US-20140221372-A1 METHOD OF ADMINISTRATION AND TREATMENT MET, SLCO1B3, SLCO2B1 MET 1/4885KDR 75/4885RET 7/4885
US-20090274693-A1 Method of Treating Cancer using a cMet and AXL Inhibitor and an ErbB Inhibitor ERBB3, ERBB2, EGFR MET 8/4885KDR 46/4885RET 5/4885
US-20130142790-A1 Method of Treating Cancer Using a cMET and AXL Inhibitor and an ErbB Inhibitor ERBB3, ERBB2, EGFR MET 8/4885KDR 49/4885RET 6/4885
US-20130150363-A1 Method of Treating Cancer Using a cMET and AXL Inhibitor and an ErbB Inhibitor ERBB3, ERBB2, EGFR MET 8/4885KDR 46/4885RET 5/4885

“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.