SCHEMBL8766760

SCHEMBL8766760

CC(C)(C)c1cc(N(CCCCc2ccccc2)CP(=O)(O)O)cc(C(C)(C)C)c1O

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
GAA P10253 1/20 0.45
FDPS P14324 5/20 0.44
GGPS1 O95749 1/20 0.44
SIGMAR1 Q99720 2/20 0.40
S1PR2 O95136 1/20 0.38
S1PR4 O95977 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38
LMNA P02545 2/20 0.37
RECQL P46063 1/20 0.37
LTB4R Q15722 1/20 0.37
KDM4E B2RXH2 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37

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
SCHEMBL8766658 0.99 MEN1 (0.46) MEN1KMT2AGAAFDPSGGPS1
SCHEMBL8616827 0.93 GAA (0.47) MEN1KMT2AGAAFDPSGGPS1
SCHEMBL8766041 0.86 FDPS (0.42) MEN1KMT2AFDPSGGPS1SIGMAR1
SCHEMBL8766488 0.86 MEN1 (0.43) MEN1KMT2AGAAFDPSGGPS1
SCHEMBL8766155 0.85 HMGCR (0.42) MEN1KMT2AGAAFDPSGGPS1
SCHEMBL7119208 0.84 HMGCR (0.43) MEN1KMT2AGAAFDPSGGPS1
SCHEMBL8766532 0.83 HMGCR (0.45) MEN1KMT2AGAAFDPSGGPS1
SCHEMBL8766734 0.83 ESRRG (0.41) MEN1KMT2AGAALMNARECQL
SCHEMBL8766181 0.82 GAA (0.50) MEN1KMT2AGAAFDPSGGPS1
SCHEMBL8766645 0.81 FDPS (0.41) MEN1KMT2AGAAFDPSLMNA

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