SCHEMBL8766181

SCHEMBL8766181

CC(C)(C)c1cc(CN(CCCc2ccccc2)CP(=O)(O)O)cc(C(C)(C)C)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 2/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
MAPK1 P28482 1/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
FDPS P14324 5/20 0.46
LMNA P02545 3/20 0.43
TSHR P16473 1/20 0.43
BCHE P06276 5/20 0.42
CHRM2 P08172 1/20 0.40
HTR1A P08908 1/20 0.40
ADRA2A P08913 1/20 0.40
CHRM1 P11229 1/20 0.40
DRD1 P21728 1/20 0.40
SLC6A2 P23975 1/20 0.40

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
SCHEMBL8766047 0.86 GAA (0.46) GAAMEN1KMT2AALDH1A1KDM4E
SCHEMBL8766658 0.83 MEN1 (0.46) GAAMEN1KMT2AKDM4EFDPS
SCHEMBL8766760 0.82 MEN1 (0.45) GAAMEN1KMT2AKDM4EFDPS
SCHEMBL8616827 0.80 GAA (0.47) GAAMEN1KMT2AALDH1A1KDM4E
SCHEMBL10024125 0.77 ALDH1A1 (0.63) GAAMEN1KMT2AALDH1A1KDM4E
SCHEMBL11578296 0.75 GAA (0.54) GAAMEN1KMT2AALDH1A1MAPT
SCHEMBL8766488 0.74 MEN1 (0.43) GAAMEN1KMT2AKDM4EFDPS
SCHEMBL8766605 0.73 FDPS (0.41) GAAMEN1KMT2AFDPSLMNA
SCHEMBL9315265 0.73 ALDH1A1 (0.57) GAAMEN1KMT2AALDH1A1KDM4E
SCHEMBL8766040 0.73 ALDH1A1 (0.53) GAAMEN1KMT2AALDH1A1KDM4E

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