SCHEMBL6662822

SCHEMBL6662822

CC(C)[C@H](N(c1ccccc1)c1ccccc1)P(=O)(O)O

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.45
ACP3 P15309 9/20 0.42
MEN1 O00255 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
ANPEP P15144 1/20 0.39
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
ALDH1A1 P00352 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
SCHEMBL6662826 1.00 SRC (0.45) SRCACP3MEN1HTTKMT2A
SCHEMBL1436836 0.73 HTT (0.38) SRCACP3MEN1HTTKMT2A
SCHEMBL1436834 0.73 HTT (0.38) SRCACP3MEN1HTTKMT2A
SCHEMBL9313408 0.71 MEN1 (0.48) SRCACP3MEN1HTTKMT2A
Phosphoric Acid SCHEMBL8412557 0.69 LMNA (0.38) SRCACP3MEN1HTTKMT2A
SCHEMBL232549 0.69 SRC (0.60) SRCACP3ANPEP
SCHEMBL11415341 0.68 ALDH1A1 (0.41) ACP3MEN1HTTKMT2AALDH1A1
SCHEMBL6565838 0.68 SRC (0.54) SRCACP3ANPEP
SCHEMBL9313395 0.68 SRC (0.48) SRCACP3MEN1HTTKMT2A
SCHEMBL8349435 0.68 MEN1 (0.45) SRCMEN1HTTKMT2A

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