SCHEMBL6162587

SCHEMBL6162587

Cc1cc(-c2ccc(F)cc2)ccc1C1CCN(CC(O)c2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
HTT P42858 1/20 0.47
SLC18A3 Q16572 2/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
GAA P10253 1/20 0.45
OPRM1 P35372 2/20 0.44
OPRD1 P41143 1/20 0.44
PRCP P42785 2/20 0.44
OPRL1 P41146 1/20 0.44
KCNH2 Q12809 1/20 0.44
GMNN O75496 1/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
NFKB1 P19838 1/20 0.43
THPO P40225 1/20 0.43
MTOR P42345 1/20 0.43
BLM P54132 1/20 0.43

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
SCHEMBL6162676 0.83 CHRNA7 (0.58) KDM4ETSHR
SCHEMBL6159875 0.78 HTR2A (0.54) SLC18A3KMT2AOPRM1OPRL1KCNH2
SCHEMBL6158959 0.76 MEN1 (0.51) KDM4EHTTMEN1KMT2AGAA
SCHEMBL6159481 0.76 OPRL1 (0.44) OPRM1OPRL1KCNH2
SCHEMBL6158951 0.76 MEN1 (0.51) KDM4EHTTMEN1KMT2AGAA
SCHEMBL6160819 0.75 DRD2 (0.55) OPRM1OPRL1KCNH2
SCHEMBL9500310 0.74 HTR2A (0.64) KDM4EHTTMEN1KMT2AGMNN
SCHEMBL8219883 0.74 SLC18A3 (0.60) KDM4EHTTSLC18A3MEN1KMT2A
SCHEMBL6162591 0.72 OPRL1 (0.37) OPRM1OPRL1KCNH2
SCHEMBL14701354 0.71 PRCP (0.84) KDM4EHTTSLC18A3MEN1KMT2A

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 3 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
EP-0755923-A1 AMELIORANT OR REMEDY FOR SYMPTOMS CAUSED BY ISCHEMIC DISEASES AND COMPOUNDS USEFUL THEREFOR SUNTORY LIMITED (JP) 1997-01-29 EP disclosed