SCHEMBL5839239

SCHEMBL5839239

COc1cc2ncnc(NCc3ccc(Oc4cccc(C(=O)NCCN5CCCCC5)c4)cc3)c2cc1OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 3/20 0.58
FLT4 P35916 3/20 0.58
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
EGFR P00533 7/20 0.51
KDR P35968 5/20 0.51
HTT P42858 3/20 0.50
PDGFRA P16234 1/20 0.49
SUV39H1 O43463 1/20 0.49
AURKA O14965 1/20 0.49
KDM4E B2RXH2 2/20 0.49
LMNA P02545 1/20 0.49
HPGD P15428 1/20 0.49
ALDH1A1 P00352 1/20 0.48
LCK P06239 1/20 0.48
MAPK1 P28482 1/20 0.47
FLT1 P17948 1/20 0.46
DRD4 P21917 1/20 0.46
ERBB2 P04626 1/20 0.46
JAK3 P52333 1/20 0.46

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
SCHEMBL4458863 0.82 ERBB2 (0.60) EGFRKDRSUV39H1AURKAERBB2
SCHEMBL5840485 0.80 PDGFRB (0.58) PDGFRBFLT4MEN1KMT2AEGFR
SCHEMBL4472351 0.77 ERBB2 (0.71) EGFRKDRSUV39H1ERBB2
SCHEMBL8809879 0.76 EGFR (0.82) MEN1KMT2AEGFRHTTKDM4E
SCHEMBL8737039 0.75 DRD4 (0.64) KMT2ALMNADRD4
SCHEMBL618488 0.73 RAF1 (0.61) LMNAHPGDDRD4
SCHEMBL5839290 0.72 MEN1 (0.62) PDGFRBFLT4MEN1KMT2AEGFR
SCHEMBL6181626 0.71 MEN1 (1.00) MEN1KMT2AEGFRHTTKDM4E
SCHEMBL5824969 0.71 PDGFRA (0.73) FLT4KDRPDGFRAFLT1
SCHEMBL20782507 0.71 HTT (0.69) MEN1KMT2AEGFRKDRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636195-A1 QUINAZOLINES AND PYRIDO[3,4-D]PYRIMIDINES AS RECEPTOR TYROSINE KINASE INHIBITORS Pfizer Products Inc. (US) 2006-03-22 EP disclosed
WO-2004106308-A1 QUINAZOLINES AND PYRIDO [3,4-D] PYRIMIDINES AS RECEPTOR TYROSINE KINASE INHIBITORS PFIZER PRODUCTS INC. (US) 2004-12-09 WO disclosed