SCHEMBL7794635

SCHEMBL7794635

CCN(C)c1ccc(C=N[C@@H]2CCCC[C@H]2N=Cc2ccc(N(C)CC)cc2O)c(O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.51
MAPT P10636 16/20 0.45
ALDH1A1 P00352 15/20 0.45
GAA P10253 8/20 0.45
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
HTT P42858 4/20 0.45
TDP1 Q9NUW8 3/20 0.45
THRB P10828 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
KDM4E B2RXH2 9/20 0.45
LMNA P02545 5/20 0.45
CRHBP P24387 1/20 0.45
CRHR2 Q13324 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.43
BLM P54132 1/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
HPGD P15428 5/20 0.41

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
SCHEMBL7794628 1.00 L3MBTL1 (0.51) L3MBTL1MAPTALDH1A1GAAMEN1
SCHEMBL30416035 0.88 MAPT (0.59) L3MBTL1MAPTALDH1A1GAAMEN1
SCHEMBL22493837 0.88 MAPT (0.59) L3MBTL1MAPTALDH1A1GAAMEN1
SCHEMBL6816766 0.84 MAPT (0.54) L3MBTL1MAPTALDH1A1GAAMEN1
SCHEMBL6816773 0.84 MAPT (0.54) L3MBTL1MAPTALDH1A1GAAMEN1
SCHEMBL6811083 0.83 L3MBTL1 (0.64) L3MBTL1MAPTALDH1A1GAAMEN1
SCHEMBL6811086 0.83 L3MBTL1 (0.64) L3MBTL1MAPTALDH1A1GAAMEN1
SCHEMBL6742963 0.82 L3MBTL1 (0.51) L3MBTL1MAPTALDH1A1GAAMEN1
SCHEMBL6560938 0.82 ALDH1A1 (0.58) L3MBTL1MAPTALDH1A1GAAMEN1
SCHEMBL6560945 0.82 ALDH1A1 (0.58) L3MBTL1MAPTALDH1A1GAAMEN1

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
EP-1159259-A1 MANGANESE COMPLEXES OF SALEN LIGANDS AND THE USE THEREOF Ciba SC Holding AG (CH) 2001-12-05 EP disclosed
WO-2000053574-A1 MANGANESE COMPLEXES OF SALEN LIGANDS AND THE USE THEREOF CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-09-14 WO disclosed