SCHEMBL28607124

SCHEMBL28607124

Cc1cccc(OP(=O)(ON=[N+]=[N-])Oc2cccc(C)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.45
NPSR1 Q6W5P4 2/20 0.45
GAA P10253 1/20 0.45
MAPK1 P28482 2/20 0.44
LMNA P02545 3/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
ALDH1A1 P00352 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
CYP3A4 P08684 2/20 0.41
TSHR P16473 2/20 0.41
ACHE P22303 1/20 0.41
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
ACP3 P15309 1/20 0.36
HCRTR1 O43613 1/20 0.35
PPARG P37231 1/20 0.35
HPGD P15428 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
SCHEMBL28604963 0.81 TSHR (0.60) NPSR1GAAMAPK1LMNAMAPT
SCHEMBL98878 0.80 SRC (0.48) L3MBTL1HTTALDH1A1TDP1CYP3A4
SCHEMBL29790831 0.80 ALDH1A1 (0.61) L3MBTL1NPSR1GAAMAPK1LMNA
SCHEMBL187081 0.80 ALDH1A1 (0.61) L3MBTL1NPSR1GAAMAPK1LMNA
SCHEMBL28607121 0.78 LMNA (0.44) L3MBTL1NPSR1GAAMAPK1LMNA
SCHEMBL25426237 0.77 SRC (0.48) L3MBTL1HTTALDH1A1TDP1CYP3A4
SCHEMBL3630170 0.77 L3MBTL1 (0.54) L3MBTL1NPSR1GAAMAPK1LMNA
SCHEMBL31169486 0.75 ACHE (0.55) L3MBTL1NPSR1GAAMAPK1LMNA
SCHEMBL9711564 0.75 L3MBTL1 (0.62) L3MBTL1NPSR1GAAMAPK1LMNA
SCHEMBL14047522 0.75 ACHE (0.55) L3MBTL1NPSR1GAAMAPK1LMNA

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
CN-110305160-B Synthesis method of copper-catalyzed phosphate mixed ester compound 西北大学 2021-07-23 CN claimed
CN-110305160-B Synthesis method of copper-catalyzed phosphate mixed ester compound 西北大学 2021-07-23 CN disclosed