SCHEMBL4038776

SCHEMBL4038776

CNC(=O)c1cc(COc2nnc(Nc3ccc(OC)c(Cl)c3)c3ccoc23)ccn1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.79
PDGFRB P09619 2/20 0.79
KIT P10721 2/20 0.79
FLT4 P35916 1/20 0.79
ILK Q13418 1/20 0.79
MAP3K20 Q9NYL2 1/20 0.79
GRM4 Q14833 1/20 0.41
CSF1R P07333 2/20 0.40
PTK2 Q05397 1/20 0.40
POLB P06746 2/20 0.40
GAA P10253 1/20 0.40
EGFR P00533 5/20 0.39
ERBB2 P04626 4/20 0.39
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
GFER P55789 1/20 0.38
FLT1 P17948 1/20 0.38
GAK O14976 1/20 0.37
P2RX3 P56373 1/20 0.37

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
SCHEMBL4035650 0.92 KDR (0.84) KDRPDGFRBKITFLT4ILK
SCHEMBL4035841 0.89 PDGFRB (0.83) KDRPDGFRBKITFLT4ILK
SCHEMBL4037065 0.89 KIT (0.75) KDRPDGFRBKITFLT4ILK
Telatinib SCHEMBL1250560 0.88 KDR (1.00) KDRPDGFRBKITFLT4ILK
Telatinib SCHEMBL29353813 0.88 KDR (1.00) KDRPDGFRBKITFLT4ILK
Telatinib SCHEMBL29884336 0.88 KDR (1.00) KDRPDGFRBKITFLT4ILK
Telatinib SCHEMBL4038729 0.88 KDR (0.98) KDRPDGFRBKITFLT4ILK
SCHEMBL2200989 0.88 KDR (0.82) KDRPDGFRBKITFLT4ILK
Telatinib SCHEMBL4037375 0.88 KDR (0.98) KDRPDGFRBKITFLT4ILK
SCHEMBL4037825 0.86 KIT (0.86) KDRPDGFRBKITFLT4ILK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1228063-B1 SUBSTITUTED PYRIDINES AND PYRIDAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY BAYER CORP (US) 2009-02-11 EP claimed
EP-1689720-B1 PYRAZOLYL DERIVATIVES IN THE FORM OF DRUGS FOR TREATING ACUTE OR CHRONIC NEURONAL REGRESSIONS AVENTIS PHARMA SA (FR) 2009-04-15 EP disclosed
EP-1689720-A1 PYRAZOLYL DERIVATIVES IN THE FORM OF DRUGS FOR TREATING ACUTE OR CHRONIC NEURONAL REGRESSIONS Aventis Pharma S.A. (FR) 2006-08-16 EP disclosed
WO-2005051917-A9 PYRAZOLYL DERIVATIVES IN THE FORM OF DRUGS FOR TREATING ACUTE OR CHRONIC NEURONAL REGRESSIONS AVENTIS PHARMA SA (FR) 2005-09-29 WO disclosed
WO-2005051917-A1 PYRAZOLYL DERIVATIVES IN THE FORM OF DRUGS FOR TREATING ACUTE OR CHRONIC NEURONAL REGRESSIONS AVENTIS PHARMA S.A. (FR) 2005-06-09 WO disclosed