SCHEMBL7133405

SCHEMBL7133405

Cc1c(Br)ccc2c1C(=Cc1ccc(Cl)c(Cl)c1)C(=O)N2

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 6/20 0.46
IGF1R P08069 1/20 0.43
PSEN1 P49768 2/20 0.42
PSEN2 P49810 2/20 0.42
APH1B Q8WW43 2/20 0.42
NCSTN Q92542 2/20 0.42
APH1A Q96BI3 2/20 0.42
PSENEN Q9NZ42 2/20 0.42
PLK4 O00444 2/20 0.41
PLK1 P53350 1/20 0.41
RET P07949 1/20 0.41
NAT1 P18440 1/20 0.40
SIRT1 Q96EB6 2/20 0.39
SIRT2 Q8IXJ6 1/20 0.39
SIRT3 Q9NTG7 1/20 0.39
RAF1 P04049 1/20 0.38

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
SCHEMBL7134022 0.86 LRRK2 (0.48) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL5376959 0.85 MAPT (0.44) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL7134020 0.85 LRRK2 (0.49) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL7137562 0.85 ADAMTS5 (0.52) LRRK2
SCHEMBL7134014 0.83 RET (0.48) LRRK2IGF1RPLK4RETRAF1
SCHEMBL7136228 0.82 SIRT2 (0.44) LRRK2IGF1RPSEN1PSEN2APH1B
SCHEMBL5363090 0.82 LRRK2 (0.60) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL7136802 0.82 LRRK2 (0.43) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL5366852 0.81 LRRK2 (0.50) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL7132867 0.81 PDGFRB (0.55) LRRK2IGF1RPSEN1PSEN2APH1B

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 3 patents. 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
EP-0984930-A1 2-INDOLINONE DERIVATIVES AS MODULATORS OF PROTEIN KINASE ACTIVITY Sugen, Inc. (US) 2000-03-15 EP disclosed
WO-1998050356-A1 2-INDOLINONE DERIVATIVES AS MODULATORS OF PROTEIN KINASE ACTIVITY SUGEN, INC. (US) 1998-11-12 WO disclosed