SCHEMBL8165437

SCHEMBL8165437

Cc1cc(Cl)c(OCCOc2ccc(I)cc2)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
HPGD P15428 1/20 0.48
MAPK1 P28482 1/20 0.48
REN P00797 10/20 0.46
TDP1 Q9NUW8 1/20 0.43
APP P05067 5/20 0.41
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL7602449 0.88 MAPT (0.51) MAPTL3MBTL1HPGDMAPK1REN
SCHEMBL1751411 0.85 MAPT (0.49) MAPTL3MBTL1HPGDMAPK1REN
SCHEMBL663105 0.84 REN (0.49) MAPTL3MBTL1HPGDMAPK1REN
SCHEMBL12601506 0.83 REN (0.48) MAPTL3MBTL1HPGDMAPK1REN
SCHEMBL5795265 0.83 MAPT (0.58) MAPTL3MBTL1HPGDMAPK1REN
SCHEMBL10289213 0.82 REN (0.50) MAPTL3MBTL1HPGDMAPK1REN
SCHEMBL3925202 0.82 MAPT (0.47) MAPTL3MBTL1HPGDMAPK1REN
SCHEMBL78168 0.81 L3MBTL1 (0.46) MAPTL3MBTL1HPGDMAPK1REN
SCHEMBL2547093 0.81 REN (0.52) MAPTL3MBTL1HPGDMAPK1REN
SCHEMBL2543486 0.81 REN (0.49) MAPTL3MBTL1HPGDMAPK1REN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008088690-A2 A PROCESS FOR PREPARING DIAZABICYCLO[3.3.1] NONANE COMPOUNDS MERCK & CO., INC. (US) 2008-07-24 WO disclosed