SCHEMBL6160743

SCHEMBL6160743

COc1cc(C=CCN2CC=C(c3ccc(Oc4ccccc4)cc3)CC2)ccc1O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.47
MAPT P10636 3/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
QDPR P09417 2/20 0.47
TSHR P16473 1/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
APP P05067 4/20 0.44
ACHE P22303 3/20 0.43
NFE2L2 Q16236 1/20 0.42
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL6160732 1.00 GAA (0.47) GAAMAPTKDM4EALDH1A1QDPR
SCHEMBL6160061 0.82 LMNA (0.44) GAAALDH1A1TSHRMEN1KMT2A
SCHEMBL6160070 0.82 LMNA (0.44) GAAALDH1A1TSHRMEN1KMT2A
SCHEMBL6167161 0.80 ACHE (0.58) QDPRAPPACHE
SCHEMBL6167168 0.80 ACHE (0.58) QDPRAPPACHE
SCHEMBL6158891 0.79 GAA (0.55) GAAQDPRTSHRMEN1KMT2A
SCHEMBL6158887 0.79 GAA (0.55) GAAQDPRTSHRMEN1KMT2A
SCHEMBL11585652 0.73 MAPT (0.53) GAAMAPTKDM4EALDH1A1TSHR
SCHEMBL11585649 0.73 MAPT (0.53) GAAMAPTKDM4EALDH1A1TSHR
SCHEMBL3364855 0.72 APP (0.62) GAAMAPTKDM4EALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0755923-B1 Ameliorant or remedy for symptoms caused by Ischemic diseases and Phenylpiperidine compounds useful therefor DAIICHI SUNTORY PHARMA CO LTD (JP) 2005-05-04 EP disclosed
US-6469010-B1 COMPOSITION ALSO FOR ALLEVIATION OR TREATMENT OF SYMPTOMS DERIVED FROM SEIZURES, EPILEPSY AND MIGRAINE HEADACHES, AND SUPPRESSION OF CALCIUM ION OVERLOAD SUNTORY LIMITED (JP) 2002-10-22 US disclosed
US-6048876-A ANTICONVULSANTS; ANTIEPILEPIC AGENT SUNTORY LIMITED (JP) 2000-04-11 US disclosed
EP-0755923-A1 AMELIORANT OR REMEDY FOR SYMPTOMS CAUSED BY ISCHEMIC DISEASES AND COMPOUNDS USEFUL THEREFOR SUNTORY LIMITED (JP) 1997-01-29 EP disclosed