SCHEMBL8469643

SCHEMBL8469643

NC(=O)OCC(O)C(O)C(O)C(O)C(O)C=O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MPI P34949 1/20 0.35
CYP1A2 P05177 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CYP2D6 P10635 1/20 0.33
PKM P14618 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ALOX15 P16050 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL789905 0.98 MPI (0.36) MPICYP1A2SMN1; SMN2CYP2D6PKM
SCHEMBL2781260 0.92 MPI (0.37) MPICYP1A2SMN1; SMN2CYP2D6PKM
SCHEMBL3327489 0.83 MPI (0.32) MPI
SCHEMBL624112 0.81 MPI (0.37) MPI
SCHEMBL419463 0.81 MPI (0.37) MPI
SCHEMBL2354360 0.79 MPI (0.36) MPI
SCHEMBL426315 0.79 MPI (0.36) MPISMN1; SMN2LMNA
SCHEMBL2884877 0.79 MPI (0.36) MPISMN1; SMN2LMNA
Bicarbonate SCHEMBL8384988 0.79 MPI (0.36) MPI
SCHEMBL215097 0.79 MPI (0.36) MPISMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0772617-B1 7-O-CARBAMOYL HEPTOSE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND THEIR USE AND SCREENING PROCESS FOR THEIR DETECTION FORSCH BORSTEL INST FUER EXPER (DE) 1999-06-23 EP claimed
US-5798343-A TREATING GRAM-NEGATIVE BACTERIA WITH HYDROFLUORIC ACID, HYDROLYZING OR METHOLYZING, PERMETHYLATING FORSCHUNGSINSTITUT BORSTEL INSTITUT FUR EXPERIMENTELLE BIOLOGIE UND MEDIZIN (DE) 1998-08-25 US claimed
EP-0772617-A1 7-O-CARBAMOYL HEPTOSE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND THEIR USE AND SCREENING PROCESS FOR THEIR DETECTION Forschungsinstitut Borstel Institut für Experimentelle Biologie und Medizin (DE) 1997-05-14 EP claimed
WO-1996002550-A1 7-O-CARBAMOYL HEPTOSE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND THEIR USE AND SCREENING PROCESS FOR THEIR DETECTION FORSCHUNGSINSTITUT BORSTEL INSTITUT FÜR EXPERIMENTELLE BIOLOGIE UND MEDIZIN (DE) 1996-02-01 WO claimed
EP-0772617-B1 7-O-CARBAMOYL HEPTOSE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND THEIR USE AND SCREENING PROCESS FOR THEIR DETECTION FORSCH BORSTEL INST FUER EXPER (DE) 1999-06-23 EP disclosed
US-5798343-A TREATING GRAM-NEGATIVE BACTERIA WITH HYDROFLUORIC ACID, HYDROLYZING OR METHOLYZING, PERMETHYLATING FORSCHUNGSINSTITUT BORSTEL INSTITUT FUR EXPERIMENTELLE BIOLOGIE UND MEDIZIN (DE) 1998-08-25 US disclosed
US-5798343-A TREATING GRAM-NEGATIVE BACTERIA WITH HYDROFLUORIC ACID, HYDROLYZING OR METHOLYZING, PERMETHYLATING FORSCHUNGSINSTITUT BORSTEL INSTITUT FUR EXPERIMENTELLE BIOLOGIE UND MEDIZIN (DE) 1998-08-25 US disclosed
EP-0772617-A1 7-O-CARBAMOYL HEPTOSE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND THEIR USE AND SCREENING PROCESS FOR THEIR DETECTION Forschungsinstitut Borstel Institut für Experimentelle Biologie und Medizin (DE) 1997-05-14 EP disclosed
WO-1996002550-A1 7-O-CARBAMOYL HEPTOSE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND THEIR USE AND SCREENING PROCESS FOR THEIR DETECTION FORSCHUNGSINSTITUT BORSTEL INSTITUT FÜR EXPERIMENTELLE BIOLOGIE UND MEDIZIN (DE) 1996-02-01 WO disclosed