SCHEMBL7119728

SCHEMBL7119728

CC(C)(C)c1cc(N(Cc2ccncc2)CP(=O)(O)O)cc(C(C)(C)C)c1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 3/20 0.39
LMNA P02545 2/20 0.39
TSHR P16473 2/20 0.39
MAPT P10636 3/20 0.36
MAPK1 P28482 2/20 0.36
RECQL P46063 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
FDPS P14324 1/20 0.35
HMGCR P04035 2/20 0.34
USP2 O75604 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34

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
SCHEMBL8766040 0.87 ALDH1A1 (0.53) GAAMEN1KMT2AALDH1A1LMNA
SCHEMBL8767384 0.86 NR1H4 (0.45) GAAMEN1KMT2AALDH1A1LMNA
SCHEMBL7123134 0.85 HMGCR (0.44) GAAMEN1KMT2AALDH1A1LMNA
SCHEMBL8766589 0.81 GAA (0.47) GAAMEN1KMT2AALDH1A1MAPT
SCHEMBL8766964 0.80 ALDH1A1 (0.48) GAAMEN1KMT2AALDH1A1LMNA
SCHEMBL8766734 0.75 ESRRG (0.41) GAAMEN1KMT2AALDH1A1LMNA
SCHEMBL8616827 0.75 GAA (0.47) GAAMEN1KMT2AALDH1A1LMNA
SCHEMBL8766658 0.74 MEN1 (0.46) GAAMEN1KMT2ALMNARECQL
SCHEMBL8767353 0.74 MEN1 (0.49) GAAMEN1KMT2AALDH1A1TSHR
SCHEMBL8766760 0.73 MEN1 (0.45) GAAMEN1KMT2ALMNARECQL

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 2 patents. 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
US-6660724-B1 Aminophosphonates alpha substituted by phenol; lipoprotein lowering activity ILEX PRODUCTS, INC. 2003-12-09 US disclosed