SCHEMBL7134362

SCHEMBL7134362

O=C1Nc2c(Br)cc(Br)cc2C1=Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 3/20 0.51
SIRT1 Q96EB6 2/20 0.51
SIRT3 Q9NTG7 1/20 0.51
IGF1R P08069 1/20 0.45
LRRK2 Q5S007 3/20 0.44
PLK4 O00444 2/20 0.44
PLK1 P53350 1/20 0.42
NAT1 P18440 1/20 0.42
PSEN1 P49768 2/20 0.41
PSEN2 P49810 2/20 0.41
APH1B Q8WW43 2/20 0.41
NCSTN Q92542 2/20 0.41
APH1A Q96BI3 2/20 0.41
PSENEN Q9NZ42 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MAP1LC3B Q9GZQ8 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
SCHEMBL7136821 0.86 LRRK2 (0.51) SIRT2SIRT1SIRT3LRRK2PLK4
SCHEMBL5365589 0.85 KMT2A (0.51) SIRT2SIRT1SIRT3PLK4PLK1
SCHEMBL7134041 0.84 ADAMTS5 (0.53) SIRT2SIRT1SIRT3MEN1KMT2A
SCHEMBL7135159 0.84 LRRK2 (0.48) SIRT2SIRT1SIRT3LRRK2PLK4
SCHEMBL5361431 0.82 METAP1 (0.54) SIRT2SIRT1SIRT3LRRK2PLK4
SCHEMBL7137447 0.82 LRRK2 (0.59) SIRT2SIRT1SIRT3LRRK2PLK4
SCHEMBL7137977 0.82 PLK4 (0.44) SIRT2SIRT1SIRT3LRRK2PLK4
SCHEMBL7137520 0.81 ALDH1A1 (0.48) SIRT2SIRT1SIRT3PLK4MEN1
SCHEMBL5361680 0.81 SIRT2 (0.54) SIRT2SIRT1SIRT3PLK4MEN1
SCHEMBL5377009 0.81 CISD1 (0.48) SIRT2SIRT1SIRT3PLK4PLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6506763-B2 Useful in prevention and treatment of protein kinase related disorders such as cancer SUGEN, INC. 2003-01-14 US disclosed