SCHEMBL28607121

SCHEMBL28607121

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

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.44
HTT P42858 3/20 0.44
MAPT P10636 2/20 0.44
ACHE P22303 1/20 0.43
L3MBTL1 Q9Y468 4/20 0.42
TDP1 Q9NUW8 2/20 0.42
NPSR1 Q6W5P4 2/20 0.41
GAA P10253 2/20 0.41
MAPK1 P28482 2/20 0.40
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
HCRTR1 O43613 1/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.36
POLB P06746 1/20 0.36
FDPS P14324 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
SCHEMBL28642959 0.84 HCRTR1 (0.48) LMNAACHEL3MBTL1NPSR1GAA
SCHEMBL9257941 0.80 TSHR (0.53) LMNAMAPTACHENPSR1GAA
SCHEMBL80417 0.79 SRC (0.52) LMNAHTTL3MBTL1TDP1KMT2A
SCHEMBL2303782 0.79 SRC (0.52) LMNAHTTL3MBTL1TDP1KMT2A
SCHEMBL28607124 0.78 L3MBTL1 (0.45) LMNAHTTMAPTACHEL3MBTL1
SCHEMBL31169481 0.75 SRC (0.58) LMNAHTTMAPTACHEL3MBTL1
SCHEMBL540087 0.75 SRC (0.58) LMNAHTTMAPTACHEL3MBTL1
SCHEMBL3388030 0.75 LMNA (0.53) LMNAHTTMAPTACHEL3MBTL1
SCHEMBL29758988 0.75 LMNA (0.53) LMNAHTTMAPTACHEL3MBTL1
SCHEMBL30529849 0.75 LMNA (0.53) LMNAHTTMAPTACHEL3MBTL1

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