SCHEMBL6667602

SCHEMBL6667602

CCO[P@@](=O)(O)C(CC)NC(c1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.49
NPSR1 Q6W5P4 2/20 0.42
MAPK1 P28482 2/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
MAPT P10636 3/20 0.41
ALDH1A1 P00352 2/20 0.41
GAA P10253 1/20 0.41
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 2/20 0.39
PTPN9 P43378 1/20 0.39
ACHE P22303 1/20 0.39
MEN1 O00255 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ACP3 P15309 1/20 0.38

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
SCHEMBL6662510 0.89 POLB (0.47) POLBNPSR1MAPK1HPGDALOX15
SCHEMBL6664553 0.86 POLB (0.44) POLBNPSR1MAPK1HPGDALOX15
SCHEMBL6659004 0.85 POLB (0.43) POLBNPSR1MAPK1HPGDALOX15
SCHEMBL8728627 0.84 POLB (0.43) POLBNPSR1KMT2ASMN1; SMN2
SCHEMBL6662168 0.84 POLB (0.50) POLBNPSR1MAPK1HPGDALOX15
SCHEMBL6666862 0.84 POLB (0.50) POLBNPSR1MAPK1HPGDALOX15
SCHEMBL6662872 0.83 ACP3 (0.46) POLBLMNAACP3
SCHEMBL8050570 0.83 ACP3 (0.46) POLBLMNAACP3
SCHEMBL6660313 0.77 GAA (0.45) POLBNPSR1TSHRMAPTALDH1A1
SCHEMBL6237835 0.76 POLB (0.59) POLBNPSR1MAPK1HPGDALOX15

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-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 claimed
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 claimed