SCHEMBL6052155

SCHEMBL6052155

Nc1ccc(N2CCC(N3CCOCC3)CC2)c(Br)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
GAA P10253 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALDH1A1 P00352 3/20 0.41
HTT P42858 1/20 0.41
HRH3 Q9Y5N1 1/20 0.38
L3MBTL3 Q96JM7 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MAP4K4 O95819 1/20 0.38
AOC3 Q16853 2/20 0.37
LGMN Q99538 1/20 0.37
ACP1 P24666 2/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
RAF1 P04049 1/20 0.36
BRAF P15056 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL2744374 0.85 MAPT (0.67) MAPTGAASMN1; SMN2ALDH1A1HTT
SCHEMBL6052293 0.84 MAPT (0.72) MAPTGAASMN1; SMN2ALDH1A1HTT
SCHEMBL17450416 0.83 ALDH1A1 (0.54) MAPTGAASMN1; SMN2ALDH1A1HTT
SCHEMBL6052282 0.83 MAPT (0.55) MAPTGAASMN1; SMN2ALDH1A1HTT
SCHEMBL2448297 0.81 MAPT (0.50) MAPTGAASMN1; SMN2ALDH1A1HTT
SCHEMBL17631428 0.80 GAA (0.47) MAPTGAASMN1; SMN2ALDH1A1HTT
SCHEMBL6052248 0.80 MAPT (0.47) MAPTGAASMN1; SMN2ALDH1A1HTT
SCHEMBL6052308 0.79 GFER (0.60) MAPTGAASMN1; SMN2ALDH1A1HTT
SCHEMBL17264117 0.79 ALDH1A1 (0.50) MAPTGAASMN1; SMN2ALDH1A1HTT
SCHEMBL77976 0.77 L3MBTL3 (0.59) MAPTGAAALDH1A1HTTHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7015218-B1 Amide compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2006-03-21 US disclosed
EP-1176140-B1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP disclosed
EP-1176140-A1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2002-01-30 EP disclosed