SCHEMBL6663173

SCHEMBL6663173

CC(C)C(NC(c1ccccc1)c1ccccc1)P(=O)(O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 12/20 0.51
SRC P12931 1/20 0.47
MMP2 P08253 1/20 0.44
MMP7 P09237 1/20 0.44
MMP9 P14780 1/20 0.44
MMP8 P22894 1/20 0.44
MMP13 P45452 1/20 0.44
MMP14 P50281 1/20 0.44
ANPEP P15144 1/20 0.44
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
CA12 O43570 1/20 0.39
CA9 Q16790 1/20 0.39
LMNA P02545 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL6663140 1.00 ACP3 (0.51) ACP3SRCMMP2MMP7MMP9
SCHEMBL8056108 0.81 ACP3 (0.54) ACP3SRCANPEPGRIN2DGRIN3B
SCHEMBL6665204 0.81 ACP3 (0.54) ACP3SRCANPEPGRIN2DGRIN3B
SCHEMBL6660044 0.79 ALDH1A1 (0.42) ACP3NPSR1
SCHEMBL6661298 0.76 ACP3 (0.66) ACP3SRCGRIN2DGRIN3BGRIN1
SCHEMBL6665273 0.75 ACP3 (0.47) ACP3SRCANPEPGRIN2DGRIN3B
SCHEMBL8038647 0.75 ACP3 (0.47) ACP3SRCANPEPGRIN2DGRIN3B
SCHEMBL8050570 0.74 ACP3 (0.46) ACP3SRCANPEPGRIN2DGRIN3B
SCHEMBL6662872 0.74 ACP3 (0.46) ACP3SRCANPEPGRIN2DGRIN3B
SCHEMBL6660908 0.71 ACP3 (0.44) ACP3SRCANPEPGRIN2DGRIN3B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0877028-B1 PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE 1-AMINOPHOSPHONIC ACID DERIVATIVES AND NOVEL PHOSPHONATE COMPOUNDS HOKKO CHEM IND CO (JP) 2004-08-25 EP disclosed
US-6084123-A REACTING AN IMINE WITH A PHOSPHONIC ACID ESTER USING AN ASYMMETRIC CATALYST OF A RARE EARTH METAL/ALKALI METAL-BINAPHTHOL COMPLEX; HYDROGENATION AND ACIDOLYSIS HOKKO CHEMICAL INDUSTRY CO., LTD. (JP) 2000-07-04 US disclosed
EP-0877028-A1 PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE 1-AMINOPHOSPHONIC ACID DERIVATIVES AND NOVEL PHOSPHONATE COMPOUNDS HOKKO CHEMICAL INDUSTRY CO. LTD. (JP) 1998-11-11 EP disclosed