SCHEMBL4282402

SCHEMBL4282402

CNC(=O)c1cc(Oc2ccc3c(c2)OCCN3C(=O)Nc2cccc(C(F)(F)F)c2)ncn1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.57
MAPK14 Q16539 8/20 0.49
TNNI3K Q59H18 8/20 0.49
LCK P06239 4/20 0.49
PLK4 O00444 1/20 0.49
AURKA O14965 1/20 0.49
MAPK13 O15264 1/20 0.49
JAK2 O60674 1/20 0.49
MAP4K4 O95819 1/20 0.49
ABL1 P00519 1/20 0.49
FYN P06241 1/20 0.49
LYN P07948 1/20 0.49
RET P07949 1/20 0.49
ROS1 P08922 1/20 0.49
SRC P12931 1/20 0.49
RPS6KB1 P23443 1/20 0.49
EPHA2 P29317 1/20 0.49
TYK2 P29597 1/20 0.49
AXL P30530 1/20 0.49
FRK P42685 1/20 0.49

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
SCHEMBL10261459 0.92 KDR (0.52) KDRMAPK14TNNI3KLCKBRAF
SCHEMBL12024426 0.89 KDR (0.72) KDRMAPK14TNNI3KLCKPLK4
SCHEMBL2437401 0.89 KDR (0.62) KDRMAPK14TNNI3KBRAF
SCHEMBL2435957 0.89 KDR (0.62) KDRMAPK14TNNI3KLCKBRAF
SCHEMBL2433093 0.81 KDR (0.64) KDRMAPK14TNNI3KBRAF
SCHEMBL2437406 0.81 KDR (0.63) KDRMAPK14TNNI3KBRAFFLT1
SCHEMBL2433982 0.80 KDR (0.58) KDRMAPK14TNNI3KLCKRET
SCHEMBL2434322 0.80 KDR (0.51) KDRMAPK14TNNI3KRETBRAF
SCHEMBL12972410 0.79 RIPK1 (0.51) KDRMAPK14TNNI3KRETBRAF
SCHEMBL2777935 0.78 RIPK1 (0.53) KDRMAPK14TNNI3KBRAFFLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120172386-A1 Combinations Comprising a VEGF Receptor Inhibitor NOVARTIS AG (CH) 2012-07-05 US disclosed
US-20120172386-A1 Combinations Comprising a VEGF Receptor Inhibitor NOVARTIS AG (CH) 2012-07-05 US disclosed
EP-1945217-B1 COMBINATIONS COMPRISING A VEGF RECEPTOR INHIBITOR AND A PENETRATION ENHANCER NOVARTIS AG (CH) 2012-05-02 EP disclosed
US-20110301157-A1 BICYCLIC AMIDES AS KINASE INHIBITORS NOVARTIS AG 2011-12-08 US disclosed
US-20110301157-A1 BICYCLIC AMIDES AS KINASE INHIBITORS NOVARTIS AG 2011-12-08 US disclosed
US-8026247-B2 Bicyclic amides as kinase inhibitors NOVARTIS AG (CH) 2011-09-27 US disclosed
US-8026247-B2 Bicyclic amides as kinase inhibitors NOVARTIS AG (CH) 2011-09-27 US disclosed
US-20080306058-A1 Combinations Comprising a Vegf Receptor Inhibitor NOVARTIS AG 2008-12-11 US disclosed
US-20080306058-A1 Combinations Comprising a Vegf Receptor Inhibitor NOVARTIS AG 2008-12-11 US disclosed
US-20080287427-A1 Bicyclic Amides as Kinase Inhibitors NOVARTIS AG (CH) 2008-11-20 US disclosed
US-20080287427-A1 Bicyclic Amides as Kinase Inhibitors NOVARTIS AG (CH) 2008-11-20 US disclosed
WO-2007031265-A2 COMBINATIONS COMPRISING A VEGF RECEPTOR INHIBITOR AND A PENETRATION ENHANCER NOVARTIS AG (CH) 2007-03-22 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 (4 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-20080306058-A1 Combinations Comprising a Vegf Receptor Inhibitor KDR, FLT4, FLT1 KDR 1/4885MAPK14 2568/4885TNNI3K 1828/4885
US-20110301157-A1 BICYCLIC AMIDES AS KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K19 KDR 826/4885MAPK14 106/4885TNNI3K 111/4885
US-20080287427-A1 Bicyclic Amides as Kinase Inhibitors MAP3K20, MAP3K1, MAP3K19 KDR 888/4885MAPK14 101/4885TNNI3K 107/4885
US-20120172386-A1 Combinations Comprising a VEGF Receptor Inhibitor KDR, FLT4, FLT1 KDR 1/4885MAPK14 2568/4885TNNI3K 1828/4885

“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.