SCHEMBL2437154

SCHEMBL2437154

CNc1cc(Oc2ccc3c(c2)OCCN3C(=O)OCc2ccccc2)ncn1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDR P35968 13/20 0.46
TNNI3K Q59H18 3/20 0.46
LCK P06239 6/20 0.45
MET P08581 5/20 0.45
MAPK14 Q16539 2/20 0.43
TEK Q02763 2/20 0.42
GRM5 P41594 2/20 0.41
MAP2K7 O14733 3/20 0.41
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
RAF1 P04049 1/20 0.40

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
SCHEMBL2434441 0.88 KDR (0.45) KDRLCKMETTEKGRM5
SCHEMBL2708240 0.86 KDR (0.48) KDRTNNI3KLCKMETTEK
SCHEMBL2709789 0.78 KDR (0.50) KDRTNNI3KMAPK14MAP2K7RAF1
SCHEMBL2436559 0.78 KDR (0.45) KDRLCKMETTEKGRM5
SCHEMBL2437401 0.76 KDR (0.62) KDRTNNI3KMAPK14RAF1
SCHEMBL2435245 0.75 NPC1 (0.53) GRM5MAPT
SCHEMBL8446674 0.74 NPC1 (0.47) GRM5LMNAMAPTRXFP1
SCHEMBL8446716 0.73 NPC1 (0.51) GRM5MAPT
SCHEMBL31542297 0.73 NPC1 (0.51) GRM5MAPT
SCHEMBL2437252 0.73 RAF1 (0.53) KDRTNNI3KLCKMETMAPK14

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-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-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-20080287427-A1 Bicyclic Amides as Kinase Inhibitors NOVARTIS AG (CH) 2008-11-20 US disclosed
EP-1794149-A2 BICYCLIC AMIDES AS KINASE INHIBITORS Novartis AG (CH) 2007-06-13 EP disclosed
WO-2006059234-A2 BICYCLIC AMIDES AS KINASE INHIBITORS NOVARTIS AG (CH) 2006-06-08 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 1/4885TNNI3K 1828/4885LCK 1705/4885
US-20110301157-A1 BICYCLIC AMIDES AS KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K19 KDR 826/4885TNNI3K 111/4885LCK 275/4885
US-20080287427-A1 Bicyclic Amides as Kinase Inhibitors MAP3K20, MAP3K1, MAP3K19 KDR 888/4885TNNI3K 107/4885LCK 311/4885
US-20120172386-A1 Combinations Comprising a VEGF Receptor Inhibitor KDR, FLT4, FLT1 KDR 1/4885TNNI3K 1828/4885LCK 1705/4885

“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.