SCHEMBL8029644

SCHEMBL8029644

CC(C)(C)Cn1c(-c2ccoc2P(=O)(O)O)nc2cnc(N)nc21

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 8/20 0.43
PIK3CA P42336 6/20 0.35
HDAC6 Q9UBN7 1/20 0.30

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
SCHEMBL8029637 0.77 FBP1 (0.40) FBP1
SCHEMBL4956393 0.72 FBP1 (0.36) FBP1
SCHEMBL8363897 0.71 NUDT1 (0.40) FBP1
SCHEMBL4982078 0.66 DHFR (0.38) FBP1
SCHEMBL8360743 0.65 NUDT1 (0.34) FBP1
SCHEMBL30718883 0.61 CDK4 (0.49)
SCHEMBL13741964 0.60 FBP1 (1.00) FBP1
SCHEMBL4981874 0.59 FBP1 (0.32) FBP1
SCHEMBL4981129 0.56 FBP1 (0.51) FBP1
SCHEMBL8363719 0.56 CTSK (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1060182-A2 NOVEL PRODRUGS FOR PHOSPHORUS-CONTAINING COMPOUNDS Metabasis Therapeutics, Inc. (US) 2000-12-20 EP claimed
WO-1999045016-A9 NOVEL PRODRUGS FOR PHOSPHORUS-CONTAINING COMPOUNDS METABASIS THERAPEUTICS INC (US) 2000-03-02 WO claimed
WO-1999045016-A2 NOVEL PRODRUGS FOR PHOSPHORUS-CONTAINING COMPOUNDS METABASIS THERAPEUTICS, INC. (US) 1999-09-10 WO claimed
EP-1060182-A2 NOVEL PRODRUGS FOR PHOSPHORUS-CONTAINING COMPOUNDS Metabasis Therapeutics, Inc. (US) 2000-12-20 EP disclosed
WO-1999045016-A9 NOVEL PRODRUGS FOR PHOSPHORUS-CONTAINING COMPOUNDS METABASIS THERAPEUTICS INC (US) 2000-03-02 WO disclosed
WO-1999045016-A2 NOVEL PRODRUGS FOR PHOSPHORUS-CONTAINING COMPOUNDS METABASIS THERAPEUTICS, INC. (US) 1999-09-10 WO disclosed