SCHEMBL29314987

SCHEMBL29314987

CC(C)(c1ccc2ncccc2c1)n1nnc2ncc(-c3ccc(P(C)(C)=O)cc3)nc21

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 0.47
PDE3B Q13370 3/20 0.42
PDE3A Q14432 3/20 0.42
PDE4C Q08493 2/20 0.42
PDE4D Q08499 2/20 0.42
CYP2C9 P11712 1/20 0.39
PDE10A Q9Y233 1/20 0.39

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
SCHEMBL29315005 0.88 MET (0.46) METPDE3BPDE3APDE4CPDE4D
SCHEMBL29314988 0.87 MET (0.49) METPDE3BPDE3APDE4CPDE4D
SCHEMBL29314974 0.85 MET (0.47) METPDE3BPDE3ACYP2C9PDE10A
SCHEMBL22109173 0.83 MET (0.54) METPDE3BPDE3APDE4CPDE4D
SCHEMBL22109177 0.80 MET (0.47) METPDE3BPDE3APDE4CPDE4D
SCHEMBL22109192 0.79 MET (0.40) METPDE3BPDE3APDE4CPDE4D
SCHEMBL22109390 0.79 MET (0.75) METPDE3BPDE3ACYP2C9PDE10A
SCHEMBL30948868 0.79 MET (0.75) METPDE3BPDE3ACYP2C9PDE10A
SCHEMBL22109185 0.78 MET (0.45) METPDE3BPDE3APDE4CPDE4D
SCHEMBL22109175 0.78 MET (0.52) METPDE3BPDE3APDE4CPDE4D

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
EP-3893872-B1 ORGANOPHOSPHORUS-SUBSTITUTED COMPOUNDS AS C-MET INHIBITORS AND THERAPEUTIC USES THEREOF BETA PHARMA INC (US) 2024-07-17 EP disclosed