SCHEMBL8470938

SCHEMBL8470938

CC(C)(C)OC(=O)CCC(C[PH](=O)O)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
SLC1A1 P43005 1/20 0.37
FOLH1 Q04609 8/20 0.33
HDAC1 Q13547 2/20 0.31
HDAC2 Q92769 2/20 0.31
HDAC3 O15379 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
CA2 P00918 1/20 0.31
MAPK1 P28482 1/20 0.31
CHRM1 P11229 1/20 0.31
AKR1A1 P14550 1/20 0.31
CHRM3 P20309 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
ADRA1A P35348 1/20 0.31
HRH1 P35367 1/20 0.31
DRD3 P35462 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
SCHEMBL6379464 0.87 HDAC3 (0.31) MEN1GAAKMT2AHDAC1HDAC2
SCHEMBL7854835 0.84 MEN1 (0.39) MEN1GAAKMT2ASLC1A1FOLH1
SCHEMBL4287818 0.80 CA2 (0.52) MEN1GAAKMT2ASLC1A1FOLH1
SCHEMBL4287823 0.80 CA2 (0.52) MEN1GAAKMT2ASLC1A1FOLH1
SCHEMBL8470935 0.77 FOLH1 (0.36) MEN1GAAKMT2ASLC1A1FOLH1
SCHEMBL17079748 0.75 MEN1 (0.49) MEN1GAAKMT2ASLC1A1FOLH1
SCHEMBL8208751 0.75 FOLH1 (0.50) MEN1GAAKMT2ASLC1A1FOLH1
SCHEMBL23363788 0.75 MEN1 (0.42) MEN1GAAKMT2ASLC1A1FOLH1
SCHEMBL4269623 0.75 FOLH1 (0.56) SLC1A1FOLH1
SCHEMBL8882482 0.74 GRIK1 (0.49) MEN1GAAKMT2ASLC1A1FOLH1

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
WO-1999033847-A1 PHOSPHINIC ALKANOIC ACID DERIVATIVES GUILFORD PHARMACEUTICALS INC. (US) 1999-07-08 WO disclosed