SCHEMBL5772003

SCHEMBL5772003

O=C1Nc2cc(Br)ccc2C1=Cc1cc(Cl)c(O)c(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK4 O00444 3/20 0.65
PLK1 P53350 2/20 0.65
RAF1 P04049 7/20 0.58
MAP1LC3B Q9GZQ8 3/20 0.57
LRRK2 Q5S007 3/20 0.55
PSEN1 P49768 1/20 0.55
PSEN2 P49810 1/20 0.55
APH1B Q8WW43 1/20 0.55
NCSTN Q92542 1/20 0.55
APH1A Q96BI3 1/20 0.55
PSENEN Q9NZ42 1/20 0.55
SIRT1 Q96EB6 3/20 0.54
SIRT2 Q8IXJ6 2/20 0.54
SIRT3 Q9NTG7 2/20 0.54
KIF15 Q9NS87 2/20 0.50
ULK1 O75385 1/20 0.50
KDR P35968 1/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
EGFR P00533 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
SCHEMBL5771999 1.00 PLK4 (0.65) PLK4PLK1RAF1MAP1LC3BLRRK2
SCHEMBL1395087 0.90 PLK4 (0.79) PLK4PLK1RAF1MAP1LC3BLRRK2
SCHEMBL1395085 0.90 PLK4 (0.79) PLK4PLK1RAF1MAP1LC3BLRRK2
SCHEMBL7980521 0.86 RAF1 (0.73) PLK4PLK1RAF1MAP1LC3BLRRK2
SCHEMBL5773323 0.86 RAF1 (0.73) PLK4PLK1RAF1MAP1LC3BLRRK2
SCHEMBL5082831 0.82 RAF1 (0.73) PLK4PLK1RAF1LRRK2KIF15
SCHEMBL4727806 0.82 RAF1 (0.73) PLK4PLK1RAF1LRRK2KIF15
SCHEMBL6688476 0.81 ERBB2 (0.72) PLK4PLK1RAF1MAP1LC3BEGFR
SCHEMBL3366790 0.80 LRRK2 (0.56) PLK4PLK1RAF1MAP1LC3BLRRK2
SCHEMBL3151046 0.80 LRRK2 (0.56) PLK4PLK1RAF1MAP1LC3BLRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1003721-B1 BENZYLIDENE-1,3-DIHYDRO-INDOL-2-ONE DERIVATIVES AS RECEPTOR TYROSINE KINASE INHIBITORS, PARTICULARLY OF RAF KINASES GLAXO GROUP LTD (GB) 2006-11-02 EP disclosed
US-6268391-B1 Benzylidene-1,3-dihydro-indol-2-one derivatives a receptor tyrosine kinase inhibitors, particularly of Raf kinases GLAXO WELLCOME INC. 2001-07-31 US disclosed
EP-1003721-A1 BENZYLIDENE-1,3-DIHYDRO-INDOL-2-ONE DERIVATIVES AS RECEPTOR TYROSINE KINASE INHIBITORS, PARTICULARLY OF RAF KINASES GLAXO GROUP LIMITED (GB) 2000-05-31 EP disclosed
WO-1999010325-A1 BENZYLIDENE-1,3-DIHYDRO-INDOL-2-ONE DERIVATIVES AS RECEPTOR TYROSINE KINASE INHIBITORS, PARTICULARLY OF RAF KINASES GLAXO GROUP LIMITED (GB) 1999-03-04 WO disclosed