SCHEMBL6162036

SCHEMBL6162036

COc1ccc(C=CCN2CCC(c3ccc(Oc4ccccc4)cc3)CC2)c(OC)c1OC

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 3/20 0.43
HRH3 Q9Y5N1 1/20 0.43
KMT2A Q03164 3/20 0.42
TSHR P16473 2/20 0.42
MEN1 O00255 2/20 0.42
DRD2 P14416 1/20 0.40
BACE1 P56817 1/20 0.39

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
SCHEMBL6162033 1.00 ALDH1A1 (0.43) ALDH1A1L3MBTL1KDM4EHRH3KMT2A
SCHEMBL6162955 0.80 MEN1 (0.59) ALDH1A1L3MBTL1KDM4EHRH3KMT2A
SCHEMBL6160208 0.79 HRH3 (0.49) ALDH1A1HRH3KMT2AMEN1DRD2
SCHEMBL6160199 0.79 HRH3 (0.49) ALDH1A1HRH3KMT2AMEN1DRD2
SCHEMBL6158891 0.78 GAA (0.55) KMT2ATSHRMEN1
SCHEMBL6158887 0.78 GAA (0.55) KMT2ATSHRMEN1
SCHEMBL6162831 0.74 CCR3 (0.53) KDM4EKMT2ATSHRMEN1DRD2
SCHEMBL6162841 0.74 CCR3 (0.53) KDM4EKMT2ATSHRMEN1DRD2
SCHEMBL1152082 0.73 LMNA (0.58) ALDH1A1L3MBTL1KDM4EKMT2ATSHR
SCHEMBL1152080 0.73 LMNA (0.58) ALDH1A1L3MBTL1KDM4EKMT2ATSHR

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