SCHEMBL8766723

SCHEMBL8766723

CCOc1ccc(N(CP(=O)(O)O)c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 3/20 0.39
NR1I2 O75469 1/20 0.39
LMNA P02545 2/20 0.38
RECQL P46063 2/20 0.38
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
EPHX2 P34913 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
NQO1 P15559 1/20 0.34
LTA4H P09960 1/20 0.34
PLK1 P53350 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
MAPK1 P28482 1/20 0.33
MMP1 P03956 1/20 0.33

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
SCHEMBL8766583 0.88 HMGCR (0.43) HMGCRNR1I2LMNARECQLPTGS1
SCHEMBL8766637 0.88 CA1 (0.46) HMGCRNR1I2LMNARECQLMEN1
SCHEMBL8766028 0.84 LMNA (0.40) HMGCRNR1I2LMNARECQLPTGS1
SCHEMBL8766469 0.82 LMNA (0.38) HMGCRNR1I2LMNARECQLPTGS1
SCHEMBL8766614 0.82 GAA (0.49) HMGCRNR1I2LMNARECQLPTGS1
SCHEMBL8766672 0.79 HMGCR (0.43) HMGCRNR1I2LMNARECQLMEN1
SCHEMBL8766735 0.79 ENPP2 (0.46) LMNARECQLPTGS1PTGS2MEN1
SCHEMBL8766983 0.77 HMGCR (0.45) HMGCRNR1I2LMNARECQLPTGS1
SCHEMBL8767341 0.76 HMGCR (0.43) HMGCRNR1I2LMNARECQLPTGS1
SCHEMBL8766961 0.75 GAA (0.39) HMGCRNR1I2LMNARECQLPTGS1

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
EP-0559079-B1 Substituted aminophosphonate derivatives, process for their preparation and pharmaceutical compositions containing them SYMPHAR SA (CH) 1997-08-13 EP claimed