SCHEMBL8374338

SCHEMBL8374338

O=C[C@H](O)[C@H](O)[C@H](O)COP(O)(O)=S

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MPI P34949 1/20 0.53
PGD P52209 3/20 0.32
LPAR6 P43657 3/20 0.30
LPAR1 Q92633 3/20 0.30
LPAR4 Q99677 3/20 0.30
LPAR5 Q9H1C0 3/20 0.30
LPAR2 Q9HBW0 3/20 0.30
LPAR3 Q9UBY5 3/20 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
SCHEMBL194343 0.94 MPI (0.52) MPIPGD
SCHEMBL850111 0.82 MPI (0.78) MPIPGDLPAR5
SCHEMBL2894537 0.82 MPI (0.60) MPIPGD
SCHEMBL9737704 0.82 MPI (0.78) MPIPGDLPAR5
SCHEMBL9736731 0.82 MPI (0.78) MPIPGDLPAR5
SCHEMBL21609 0.82 MPI (0.78) MPIPGDLPAR5
SCHEMBL321875 0.82 MPI (0.78) MPIPGDLPAR5
SCHEMBL9741443 0.82 MPI (0.78) MPIPGDLPAR5
SCHEMBL939515 0.82 MPI (0.78) MPIPGDLPAR5
SCHEMBL9738232 0.82 MPI (0.78) MPIPGDLPAR5

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
US-5955571-A NOVEL N-BRANCHED NUCLEIC ACIDS WITH NON-RIBOSE PHOSPHATE BACKBONE; FOR USE IN CONTROLLING GENE EXPRESSION, ANTISENSE AGENTS, VIRICIDES, DIAGNOSIS, AND GENETIC ENGINEERING TECHNIQUES BAYER AKTIENGESELLSCHAFT (DE) 1999-09-21 US disclosed