SCHEMBL5133451

SCHEMBL5133451

CCCCC(OC)c1ccco1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.40
KMT2A Q03164 6/20 0.40
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 4/20 0.35
HPGD P15428 3/20 0.35
POLB P06746 2/20 0.35
TSHR P16473 2/20 0.34
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
GAA P10253 2/20 0.33
HTT P42858 1/20 0.33
HDAC3 O15379 1/20 0.33
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 2/20 0.33

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
SCHEMBL5134036 0.95 MEN1 (0.40) MEN1KMT2ASLC6A2SLC6A4L3MBTL1
SCHEMBL5133109 0.93 MEN1 (0.40) MEN1KMT2ASLC6A2SLC6A4L3MBTL1
SCHEMBL1287682 0.87 KMT2A (0.38) MEN1KMT2ASLC6A2SLC6A4L3MBTL1
SCHEMBL10090164 0.81 KMT2A (0.38) MEN1KMT2ASLC6A2SLC6A4L3MBTL1
SCHEMBL11007405 0.80 SLC6A2 (0.38) MEN1KMT2ASLC6A2SLC6A4L3MBTL1
SCHEMBL11007558 0.79 L3MBTL1 (0.38) MEN1KMT2ASLC6A2SLC6A4L3MBTL1
SCHEMBL7347505 0.78 MEN1 (0.39) MEN1KMT2AL3MBTL1ALDH1A1HPGD
SCHEMBL7347502 0.78 MEN1 (0.39) MEN1KMT2AL3MBTL1ALDH1A1HPGD
SCHEMBL7352760 0.77 L3MBTL1 (0.42) MEN1KMT2AL3MBTL1ALDH1A1HPGD
SCHEMBL17313457 0.77 CYP2D6 (0.39) MEN1KMT2ASLC6A2SLC6A4ALDH1A1

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-1949470-A1 POLYMERIC NANOFIBRIL NETWORK FOR PHOTOVOLTAIC CELLS COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2008-07-30 EP disclosed
WO-2007048909-A1 POLYMERIC NANOFIBRIL NETWORK FOR PHOTOVOLTAIC CELLS COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2007-05-03 WO disclosed