SCHEMBL6671646

SCHEMBL6671646

OCCc1cc(Cl)cc(NCc2ccccc2Sc2ccccc2)c1O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DDR1 Q08345 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
MAPK1 P28482 1/20 0.37
SLC6A4 P31645 3/20 0.37
CHRNA7 P36544 2/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A3 Q01959 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 1/20 0.36
ALDH1A1 P00352 1/20 0.34
BLM P54132 1/20 0.34
GAA P10253 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
SCHEMBL6227024 0.94 SLC6A4 (0.42) DDR1SMN1; SMN2L3MBTL1MAPK1SLC6A4
SCHEMBL6227969 0.92 SLC6A4 (0.46) DDR1SMN1; SMN2L3MBTL1MAPK1SLC6A4
SCHEMBL6225937 0.91 SLC6A4 (0.38) SMN1; SMN2SLC6A4SLC6A2SLC6A3MEN1
SCHEMBL6229113 0.89 HTR1A (0.35) SMN1; SMN2L3MBTL1SLC6A4SLC6A2SLC6A3
SCHEMBL6668436 0.88 KMT2A (0.51) L3MBTL1SLC6A4SLC6A2SLC6A3MEN1
SCHEMBL6229825 0.88 ITGB2 (0.38) L3MBTL1MAPK1SLC6A4SLC6A2MEN1
SCHEMBL6227046 0.87 MAPT (0.41) SMN1; SMN2L3MBTL1MAPK1MEN1KMT2A
SCHEMBL6227136 0.86 LMNA (0.39) SMN1; SMN2L3MBTL1MAPK1SLC6A4LMNA
SCHEMBL4359272 0.85 GAA (0.42) DDR1SMN1; SMN2L3MBTL1MAPK1SLC6A4
SCHEMBL6225665 0.82 MEN1 (0.38) L3MBTL1MEN1KMT2ALMNAALDH1A1

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-2004030664-A2 NEW COMPOUNDS FOR THE INHIBITION OF UNDESIRED CELL PROLIFERATION AND USE THEREOF JERINI AG (DE) 2004-04-15 WO claimed