SCHEMBL5069445

SCHEMBL5069445

Cc1cc(Cl)c(OCCc2cc[c]cc2)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
HPGD P15428 2/20 0.47
MAPK1 P28482 1/20 0.47
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NPY1R P25929 1/20 0.36
NPY2R P49146 1/20 0.36
REN P00797 5/20 0.35
NMT1 P30419 1/20 0.34
F2 P00734 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL661830 0.82 MAPT (0.48) MAPTL3MBTL1HPGDMAPK1TDP1
SCHEMBL662977 0.81 MAPT (0.47) MAPTL3MBTL1HPGDMAPK1TDP1
SCHEMBL662025 0.81 MAPT (0.47) MAPTL3MBTL1HPGDMAPK1TDP1
SCHEMBL662083 0.77 MAPT (0.43) MAPTL3MBTL1HPGDMAPK1TDP1
SCHEMBL662629 0.76 MAPT (0.43) MAPTL3MBTL1HPGDMAPK1TDP1
SCHEMBL8407758 0.74 MAPT (0.42) MAPTL3MBTL1HPGDMAPK1TDP1
SCHEMBL17087123 0.71 MAPT (0.53) MAPTL3MBTL1HPGDMAPK1TDP1
SCHEMBL2799797 0.71 MAPT (0.53) MAPTL3MBTL1HPGDMAPK1TDP1
SCHEMBL65612 0.70 MAPT (0.51) MAPTL3MBTL1HPGDMAPK1TDP1
SCHEMBL660641 0.70 MAPT (0.51) MAPTL3MBTL1HPGDMAPK1TDP1

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-1910272-A1 RENIN INHIBITORS Merck Frosst Canada Ltd. (CA) 2008-04-16 EP disclosed
WO-2007009250-A1 RENIN INHIBITORS MERCK FROSST CANADA LTD. (CA) 2007-01-25 WO disclosed