SCHEMBL28077666

SCHEMBL28077666

CCC(CC)(c1c(C)cc(C)cc1C)P(=O)(O)O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 5/20 0.40
PGK2 P07205 5/20 0.40
HPGD P15428 2/20 0.33
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
TSHR P16473 1/20 0.31
KDM4E B2RXH2 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
SRC P12931 1/20 0.30

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
SCHEMBL11759309 0.85 PGK1 (0.41) PGK1PGK2ESR1ESR2
SCHEMBL11763080 0.82 FDPS (0.42) PGK1PGK2ESR1ESR2
SCHEMBL11764105 0.79 FDPS (0.39) LMNA
SCHEMBL11761574 0.77 FDPS (0.34) PGK1PGK2LMNA
SCHEMBL11763139 0.77 FDPS (0.34) PGK1PGK2LMNA
SCHEMBL5051559 0.76 PGK1 (0.39) PGK1PGK2
SCHEMBL11762427 0.74 PGK1 (0.44) PGK1PGK2LMNASMN1; SMN2TSHR
SCHEMBL23908217 0.73 PGK1 (0.43) PGK1PGK2MEN1KMT2AESR1
SCHEMBL11763736 0.73 PGK1 (0.42) PGK1PGK2LMNAMEN1KMT2A
SCHEMBL6305096 0.72 ACP3 (0.37) PGK1PGK2MEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104231007-B Amphiphilic benzimidazole ruthenium complex for dye-sensitized solar cell and preparation method of amphiphilic benzimidazole ruthenium complex 昆明理工大学 2017-01-11 CN claimed
CN-104402930-B A kind of symmetry benzimidazole ruthenium complex and preparation method thereof 昆明理工大学 2016-08-24 CN claimed
CN-104231007-B Amphiphilic benzimidazole ruthenium complex for dye-sensitized solar cell and preparation method of amphiphilic benzimidazole ruthenium complex 昆明理工大学 2017-01-11 CN disclosed
CN-104402930-B A kind of symmetry benzimidazole ruthenium complex and preparation method thereof 昆明理工大学 2016-08-24 CN disclosed