SCHEMBL2294581

SCHEMBL2294581

COc1cc2c(Oc3ccc(NC(=O)C(=O)NCCc4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCOCC1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 16/20 0.77
FLT3 P36888 5/20 0.77
KDR P35968 3/20 0.77
AXL P30530 3/20 0.77
PDGFRB P09619 2/20 0.77
KIT P10721 2/20 0.77
PDGFRA P16234 2/20 0.77
FLT1 P17948 2/20 0.77
MST1R Q04912 2/20 0.77
PLK4 O00444 1/20 0.77
STK25 O00506 1/20 0.77
CIT O14578 1/20 0.77
AURKA O14965 1/20 0.77
CHUK O15111 1/20 0.77
MUSK O15146 1/20 0.77
EPHB6 O15197 1/20 0.77
MAPK13 O15264 1/20 0.77
MAP3K13 O43283 1/20 0.77
DAPK3 O43293 1/20 0.77
MAP3K7 O43318 1/20 0.77

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
SCHEMBL363123 0.95 MET (0.75) METFLT3KDRAXLPDGFRB
SCHEMBL12510585 0.89 MET (0.72) METFLT3KDRAXLPDGFRB
SCHEMBL1877060 0.88 MET (0.84) METFLT3KDRAXLPDGFRB
SCHEMBL371582 0.88 FLT3 (0.68) METFLT3KDRAXLPDGFRB
SCHEMBL29693576 0.88 MET (0.74) MET
SCHEMBL372073 0.88 MET (0.74) MET
SCHEMBL14670933 0.88 FLT3 (0.77) METFLT3KDRAXLPDGFRB
Foretinib SCHEMBL371804 0.87 MET (1.00) METFLT3KDRAXLPDGFRB
SCHEMBL29693444 0.87 MET (1.00) METFLT3KDRAXLPDGFRB
Foretinib SCHEMBL30498609 0.87 MET (1.00) METFLT3KDRAXLPDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080161305-A1 C-Met Modulators and Methods of Use EXELIXIS, INC. (US) 2008-07-03 US claimed
CN-111643496-A Methods of using MEK inhibitors 埃克塞利希斯股份有限公司 2020-09-11 CN disclosed
EP-2101759-B1 METHODS OF USING MEK INHIBITORS EXELIXIS INC (US) 2018-10-10 EP disclosed
US-7999006-B2 Anticancer agents; mitogen-activated protein kinases (MEK) EXELIXIS, INC. (US) 2011-08-16 US disclosed
EP-2101759-A1 METHODS OF USING MEK INHIBITORS Exelixis, Inc. (US) 2009-09-23 EP disclosed
US-20080166359-A1 Methods of using MEK inhibitors EXELIXIS, INC. 2008-07-10 US disclosed
US-20080161305-A1 C-Met Modulators and Methods of Use EXELIXIS, INC. (US) 2008-07-03 US disclosed
US-20080161305-A1 C-Met Modulators and Methods of Use EXELIXIS, INC. (US) 2008-07-03 US disclosed
US-20080161305-A1 C-Met Modulators and Methods of Use EXELIXIS, INC. (US) 2008-07-03 US disclosed
WO-2008076415-A1 METHODS OF USING MEK INHIBITORS EXELIXIS, INC. (US) 2008-06-26 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-20080161305-A1 C-Met Modulators and Methods of Use MET, HGFAC, HGF MET 1/4885FLT3 149/4885KDR 32/4885
US-20080166359-A1 Methods of using MEK inhibitors BRAF, NRAS, KRAS MET 312/4885FLT3 321/4885KDR 1023/4885

“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.