SCHEMBL6694587

SCHEMBL6694587

Cc1cc(C=C2C(=O)Nc3ccc(C#N)cc32)cc(C)c1O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 7/20 0.68
PDPK1 O15530 2/20 0.57
RAF1 P04049 5/20 0.49
MAP1LC3B Q9GZQ8 3/20 0.49
EGFR P00533 2/20 0.49
PSEN1 P49768 2/20 0.49
PSEN2 P49810 2/20 0.49
APH1B Q8WW43 2/20 0.49
NCSTN Q92542 2/20 0.49
APH1A Q96BI3 2/20 0.49
PSENEN Q9NZ42 2/20 0.49
MAPT P10636 2/20 0.49
ERBB2 P04626 1/20 0.49
PDGFRB P09619 1/20 0.49
NTRK1 P04629 1/20 0.49
ARAF P10398 1/20 0.49
PIM1 P11309 1/20 0.49
BRAF P15056 1/20 0.49
CSNK2A1 P68400 1/20 0.49
PIM3 Q86V86 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
SCHEMBL6694585 1.00 LRRK2 (0.68) LRRK2PDPK1RAF1MAP1LC3BEGFR
SCHEMBL5774062 0.85 RAF1 (0.68) LRRK2PDPK1RAF1MAP1LC3BEGFR
SCHEMBL5774067 0.85 RAF1 (0.68) LRRK2PDPK1RAF1MAP1LC3BEGFR
SCHEMBL6695402 0.85 ERBB2 (0.67) LRRK2PDPK1RAF1MAP1LC3BEGFR
SCHEMBL6695400 0.85 ERBB2 (0.67) LRRK2PDPK1RAF1MAP1LC3BEGFR
SCHEMBL6689420 0.81 LRRK2 (1.00) LRRK2RAF1EGFRPSEN1PSEN2
SCHEMBL6687017 0.81 LRRK2 (0.73) LRRK2RAF1MAP1LC3BEGFRPSEN1
SCHEMBL5476171 0.79 RAF1 (0.71) LRRK2PDPK1RAF1EGFRMAPT
SCHEMBL5476173 0.79 RAF1 (0.71) LRRK2PDPK1RAF1EGFRMAPT
SCHEMBL6692724 0.78 RAF1 (0.46) LRRK2PDPK1RAF1MAP1LC3BEGFR

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
WO-2004069998-A2 OXINDOLE DERIVATIVES AS ANTIMICROBIAL AGENTS ARROW THERAPEUTICS LIMITED (GB) 2004-08-19 WO disclosed