SCHEMBL7294266

SCHEMBL7294266

O=[C]c1ccc(OCC(=O)OCc2ccccc2)cc1OCC(=O)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.54
KDM4E B2RXH2 1/20 0.54
LMNA P02545 1/20 0.54
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 2/20 0.47
MAPK1 P28482 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
KDM5A P29375 1/20 0.44
TP53 P04637 1/20 0.43
HPGD P15428 1/20 0.42
MAOB P27338 2/20 0.42
CASP1 P29466 1/20 0.41
PPARG P37231 1/20 0.40
NCOA2 Q15596 1/20 0.40
NCOA1 Q15788 1/20 0.40

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
SCHEMBL7284280 0.84 KDM4E (0.50) POLBKDM4ELMNAMEN1KMT2A
SCHEMBL7285180 0.82 LMNA (0.55) POLBKDM4ELMNAALDH1A1MAPT
SCHEMBL7284352 0.80 KDM4E (0.53) POLBKDM4ELMNAMEN1KMT2A
SCHEMBL7294269 0.80 LMNA (0.54) POLBKDM4ELMNAMEN1KMT2A
SCHEMBL7284147 0.79 PTPN7 (0.51) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL3046274 0.78 POLB (0.68) POLBKDM4ELMNAMEN1KMT2A
SCHEMBL8436924 0.77 MAOB (0.55) POLBMEN1KMT2AALDH1A1MAPK1
SCHEMBL8681578 0.77 ALDH1A1 (0.61) POLBKDM4ELMNAKMT2AALDH1A1
SCHEMBL7284282 0.76 KDM4E (0.50) POLBKDM4ELMNAMEN1KMT2A
SCHEMBL8013977 0.76 ALOX15 (0.61) POLBKDM4ELMNAMEN1KMT2A

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
US-4760064-A Cardiotonic agent OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-07-26 US disclosed
EP-0187322-A1 Carbostyril compounds, compositions containing same and processes for preparing same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-07-16 EP disclosed