SCHEMBL7058667

SCHEMBL7058667

O=CCCP(=O)(Cl)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOX1 Q06278 1/20 0.53
CFTR P13569 1/20 0.42
ALDH1A1 P00352 4/20 0.41
GAA P10253 2/20 0.41
MAPT P10636 2/20 0.41
ALPG P10696 1/20 0.41
ALOX12 P18054 1/20 0.41
NPY1R P25929 1/20 0.41
HTT P42858 1/20 0.41
NPY2R P49146 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
CA5A P35218 1/20 0.37
TSHR P16473 2/20 0.35
ALOX15 P16050 1/20 0.35
USP2 O75604 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL11418157 0.77 CFTR (0.46) CFTRALDH1A1GAAMAPTALPG
SCHEMBL7058663 0.72 CFTR (0.42) CFTRALDH1A1GAAMAPTALPG
SCHEMBL6572723 0.72 CFTR (0.44) CFTRALDH1A1GAAMAPTALPG
SCHEMBL6894560 0.71 CFTR (0.45) CFTRALDH1A1GAAMAPTALPG
SCHEMBL28979738 0.71 ALDH1A1 (0.53) CFTRALDH1A1GAAMAPTALPG
SCHEMBL7364597 0.70 ALDH1A1 (0.48) CFTRALDH1A1GAAMAPTALPG
SCHEMBL27877604 0.70 CFTR (0.43) CFTRALDH1A1GAAMAPTALPG
SCHEMBL1607320 0.69 AOX1 (1.00) AOX1ALDH1A1GAAMAPTNPSR1
SCHEMBL7815706 0.69 NPC1 (0.47) CFTRALDH1A1GAAMAPTALPG
SCHEMBL9463262 0.69 NPSR1 (0.52) ALDH1A1GAAMAPTALPGALOX12

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-1099705-B1 Method for preparing 3-(hydroxyphenylphosphinyl)-propanoic acid SAEHAN IND INC (KR) 2004-02-11 EP claimed