SCHEMBL6013450

SCHEMBL6013450

O=P(O)(c1ccccc1-c1ccccc1O)[Y](P(=O)(O)c1ccccc1-c1ccccc1O)P(=O)(O)c1ccccc1-c1ccccc1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.39
HSD17B10 Q99714 3/20 0.39
ALDH1A1 P00352 3/20 0.39
BCL2L1 Q07817 1/20 0.39
CYP3A4 P08684 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
PTPN5 P54829 1/20 0.38
MAOA P21397 3/20 0.36
MAOB P27338 1/20 0.36
PTPN1 P18031 1/20 0.34
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPT P10636 2/20 0.33
NPC1 O15118 1/20 0.33
CA12 O43570 1/20 0.33
GMNN O75496 1/20 0.33
EGFR P00533 1/20 0.33

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
SCHEMBL7263443 0.82 ALDH1A1 (0.43) HPGDHSD17B10ALDH1A1BCL2L1CYP3A4
Phosphoric Acid SCHEMBL31187365 0.79 ALDH1A1 (0.52) HPGDHSD17B10ALDH1A1BCL2L1CYP3A4
SCHEMBL811782 0.78 CYP3A4 (0.43) HPGDHSD17B10ALDH1A1BCL2L1CYP3A4
SCHEMBL6013454 0.77 ALDH1A1 (0.39) HPGDHSD17B10ALDH1A1BCL2L1CYP3A4
SCHEMBL6013469 0.77 ALDH1A1 (0.39) HPGDHSD17B10ALDH1A1BCL2L1CYP3A4
SCHEMBL1083127 0.77 ALDH1A1 (0.39) HPGDHSD17B10ALDH1A1BCL2L1CYP3A4
SCHEMBL6013441 0.77 HPGD (0.39) HPGDHSD17B10ALDH1A1BCL2L1CYP3A4
SCHEMBL14143183 0.73 CYP1A2 (0.42) HPGDHSD17B10ALDH1A1BCL2L1CYP3A4
SCHEMBL2187517 0.72 HPGD (0.44) HPGDHSD17B10ALDH1A1BCL2L1CYP3A4
SCHEMBL18516919 0.72 CYP1A2 (0.35) HPGDHSD17B10ALDH1A1BCL2L1CYP3A4

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-1657972-A1 Phosphinate complexes of metals of the 2nd, 3rd, 12th and 13th groups and their use as flame proofing agents Schill + Seilacher "Struktol" Aktiengesellschaft (DE) 2006-05-17 EP disclosed