SCHEMBL10000458

SCHEMBL10000458

CP(=O)(O)CN(CP)CP(C)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.36
ALOX15 P16050 1/20 0.36
CA2 P00918 1/20 0.35
GABBR2 O75899 2/20 0.32
GABBR1 Q9UBS5 2/20 0.32
CYP1A2 P05177 1/20 0.32
TSHR P16473 1/20 0.32
THPO P40225 1/20 0.32
LMNA P02545 1/20 0.31
BLM P54132 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
GABRR1 P24046 1/20 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
SCHEMBL13233435 0.76 CA2 (0.37) USP2ALOX15CA2GABBR2GABBR1
SCHEMBL12198360 0.72 FDPS (0.33) USP2ALOX15CA2GABBR2GABBR1
SCHEMBL13233439 0.70 FDPS (0.32) CA2GABBR2GABBR1CYP1A2TSHR
(Dimethylamino)Methyl(Methyl)Phosphinic Acid SCHEMBL13979830 0.69
SCHEMBL13233437 0.67 S1PR2 (0.37) GABBR2GABBR1CYP1A2TSHRTHPO
SCHEMBL17736087 0.67 MEN1 (0.30) MEN1KMT2A
SCHEMBL10040035 0.67
SCHEMBL13233436 0.66 S1PR2 (0.36) GABBR2GABBR1CYP1A2TSHRTHPO
SCHEMBL13024271 0.64
SCHEMBL17488950 0.63

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-1841835-B1 FIREPROOFING AGENT PETERMUELLER MANFRED (DE) 2012-01-11 EP disclosed