SCHEMBL29050846

SCHEMBL29050846

CCCCCCCCCCC(CC(=O)CC(CCCCCCCCCC)c1ccco1)c1ccco1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
GLA P06280 1/20 0.40
HPGD P15428 1/20 0.40
RECQL P46063 1/20 0.40
GAA P10253 1/20 0.39
HDAC3 O15379 1/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
CYSLTR2 Q9NS75 1/20 0.38
CYSLTR1 Q9Y271 1/20 0.38
CYP2C19 P33261 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
HTT P42858 1/20 0.38
POLB P06746 2/20 0.38
PKM P14618 2/20 0.38
PTPN1 P18031 1/20 0.38
PTPN7 P35236 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
SCHEMBL8159767 0.85 MEN1 (0.41) MIFGAAHDAC3KMT2AMEN1
SCHEMBL18934219 0.85 MEN1 (0.41) MIFGAAHDAC3KMT2AMEN1
SCHEMBL16753021 0.83 LMNA (0.41) MIFL3MBTL1GAAHDAC3KMT2A
SCHEMBL21880815 0.82 NR1I2 (0.43) MIFGAAKMT2AMEN1ALDH1A1
SCHEMBL11354616 0.81 KMT2A (0.39) MIFL3MBTL1GLAHPGDRECQL
SCHEMBL1863820 0.80 NR1I2 (0.41) MIFL3MBTL1HPGDGAAHDAC3
SCHEMBL20914988 0.80 GAA (0.39) MIFHPGDGAAHDAC3CYSLTR2
SCHEMBL20773076 0.77 KMT2A (0.52) L3MBTL1GAAHDAC3KMT2AMEN1
SCHEMBL2828919 0.77 KMT2A (0.52) L3MBTL1GAAHDAC3KMT2AMEN1
SCHEMBL22127720 0.77 KMT2A (0.52) L3MBTL1GAAHDAC3KMT2AMEN1

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
CN-108602791-B Aromatic surfactants 明尼苏达大学评议会 2023-07-14 CN disclosed