SCHEMBL8348291

SCHEMBL8348291

O=C1Nc2ncc(-c3ccsc3)cc2/C1=C\c1cc(Br)c(O)c(Br)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 9/20 0.51
NTRK1 P04629 2/20 0.51
CCNA2 P20248 1/20 0.51
CDK2 P24941 1/20 0.51
CCNA1 P78396 1/20 0.51
PIK3C3 Q8NEB9 1/20 0.48
LRRK2 Q5S007 3/20 0.48
SIRT1 Q96EB6 3/20 0.46
MAP1LC3B Q9GZQ8 3/20 0.46
SIRT2 Q8IXJ6 2/20 0.46
SIRT3 Q9NTG7 2/20 0.46
PSEN1 P49768 1/20 0.46
PSEN2 P49810 1/20 0.46
APH1B Q8WW43 1/20 0.46
NCSTN Q92542 1/20 0.46
APH1A Q96BI3 1/20 0.46
PSENEN Q9NZ42 1/20 0.46
EGFR P00533 1/20 0.46
ARAF P10398 1/20 0.46
PIM1 P11309 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
SCHEMBL8348293 1.00 RAF1 (0.51) RAF1NTRK1CCNA2CDK2CCNA1
SCHEMBL8347333 0.85 LRRK2 (0.67) RAF1NTRK1CCNA2CDK2CCNA1
SCHEMBL8347330 0.85 LRRK2 (0.67) RAF1NTRK1CCNA2CDK2CCNA1
SCHEMBL14040856 0.82 RAF1 (0.52) RAF1NTRK1CCNA2CDK2CCNA1
SCHEMBL8352656 0.82 RAF1 (0.52) RAF1NTRK1CCNA2CDK2CCNA1
SCHEMBL5772153 0.82 LRRK2 (0.72) RAF1NTRK1PIK3C3LRRK2SIRT1
SCHEMBL5772149 0.82 LRRK2 (0.72) RAF1NTRK1PIK3C3LRRK2SIRT1
SCHEMBL8525307 0.80 LRRK2 (0.53) RAF1NTRK1CCNA2CDK2CCNA1
SCHEMBL8582684 0.80 RAF1 (0.69) RAF1NTRK1CCNA2CDK2CCNA1
SCHEMBL8582702 0.80 RAF1 (0.69) RAF1NTRK1CCNA2CDK2CCNA1

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
WO-1999021859-A1 AZAOXINDOLE DERIVATIVES GLAXO GROUP LIMITED (GB) 1999-05-06 WO claimed
WO-1999021859-A1 AZAOXINDOLE DERIVATIVES GLAXO GROUP LIMITED (GB) 1999-05-06 WO disclosed