SCHEMBL8071706

SCHEMBL8071706

CNC(=O)[C@@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](CO)OP(=O)(O)O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PGD P52209 1/20 0.32
PTPN1 P18031 1/20 0.32

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
SCHEMBL8077133 0.80 MAPT (0.39)
SCHEMBL3654045 0.79 PGD (0.33) PGDPTPN1
SCHEMBL8063785 0.79 PGD (0.33) PGDPTPN1
SCHEMBL6350847 0.78 PTPN1 (0.37) PTPN1
SCHEMBL3653539 0.73 CA12 (0.47)
SCHEMBL9737806 0.67 MPI (0.32) PTPN1
SCHEMBL9737459 0.67 MPI (0.32) PTPN1
SCHEMBL9738076 0.67 MPI (0.32) PTPN1
SCHEMBL321587 0.67 MPI (0.32) PTPN1
SCHEMBL9736063 0.67 MPI (0.32) PTPN1

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
EP-1023301-A1 A HETEROCYCLIC CHEMICAL COMPOUND PERSTORP AB (SE) 2000-08-02 EP disclosed
WO-1997018220-A1 A HETEROCYCLIC CHEMICAL COMPOUND PERSTORP AB (SE) 1997-05-22 WO disclosed