SCHEMBL28010277

SCHEMBL28010277

O=C(O)C(O)c1ccc2ccc3cccnc3c2n1.[Co]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.50
KDM4E B2RXH2 4/20 0.50
CCR1 P32246 3/20 0.50
CCR5 P51681 3/20 0.50
CCR8 P51685 3/20 0.50
MAPT P10636 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
HTT P42858 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
MMP2 P08253 2/20 0.50
TSHR P16473 2/20 0.50
GMNN O75496 1/20 0.50
TP53 P04637 1/20 0.50
HSP90AA1 P07900 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
MMP9 P14780 1/20 0.50
ALOX15 P16050 1/20 0.50
NFKB1 P19838 1/20 0.50
MMP8 P22894 1/20 0.50

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
SCHEMBL27936708 0.80 CCR1 (0.61) LMNAKDM4ECCR1CCR5CCR8
SCHEMBL28933357 0.76 LMNA (0.52) LMNAKDM4ECCR1CCR5CCR8
Phenanthroline SCHEMBL29278213 0.76 LMNA (0.67) LMNAKDM4ECCR1CCR5CCR8
SCHEMBL8686129 0.76 PARP1 (0.49) LMNAKDM4ECCR1CCR5CCR8
Phenanthroline SCHEMBL22401704 0.74 LMNA (0.70) LMNAKDM4ECCR1CCR5CCR8
Phenanthroline SCHEMBL4881417 0.74 LMNA (0.70) LMNAKDM4ECCR1CCR5CCR8
SCHEMBL6886437 0.73 LMNA (0.52) LMNAKDM4ECCR1CCR5CCR8
Phenanthroline SCHEMBL3273072 0.73 CCR1 (0.94) LMNAKDM4ECCR1CCR5CCR8
Phenanthroline SCHEMBL3838808 0.73 CCR1 (0.94) LMNAKDM4ECCR1CCR5CCR8
Phenanthroline SCHEMBL28130373 0.73 CCR1 (0.94) LMNAKDM4ECCR1CCR5CCR8

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-104445467-B A kind of degradation method of methyl red Minnan normal university (CN) 2016-02-24 CN claimed
CN-104445467-A Methyl red degradation method UNIV MINNAN NORMAL 2015-03-25 CN claimed
CN-104445467-B A kind of degradation method of methyl red Minnan normal university (CN) 2016-02-24 CN disclosed
CN-104445467-A Methyl red degradation method UNIV MINNAN NORMAL 2015-03-25 CN disclosed