SCHEMBL6158965

SCHEMBL6158965

Fc1ccc(Cc2ccc(C3CCN(CC=Cc4ccccc4)CC3)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.56
SLC6A3 Q01959 2/20 0.56
LTA4H P09960 1/20 0.56
KDM4E B2RXH2 3/20 0.55
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
MAPT P10636 4/20 0.54
CYP2D6 P10635 3/20 0.54
LMNA P02545 3/20 0.54
OPRM1 P35372 3/20 0.54
HIF1A Q16665 2/20 0.54
CYP1A2 P05177 2/20 0.54
CYP3A4 P08684 2/20 0.54
CYP2C9 P11712 2/20 0.54
MAPK1 P28482 2/20 0.54
SIGMAR1 Q99720 2/20 0.54
THPO P40225 1/20 0.54
CACNA1G O43497 1/20 0.54
CACNA1H O95180 1/20 0.54
CHRM2 P08172 1/20 0.54

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
SCHEMBL6158956 1.00 SLC6A4 (0.56) SLC6A4SLC6A3LTA4HKDM4EMEN1
SCHEMBL8208853 0.90 LTA4H (0.53) SLC6A4SLC6A3LTA4HKDM4EMEN1
SCHEMBL6160069 0.90 LTA4H (0.53) SLC6A4SLC6A3LTA4HKDM4EMEN1
SCHEMBL7725192 0.84 LMNA (0.54) LTA4HLMNAMAPK1DRD2SMN1; SMN2
SCHEMBL6162363 0.84 LMNA (0.54) LTA4HLMNAMAPK1DRD2SMN1; SMN2
SCHEMBL6162831 0.84 CCR3 (0.53) SLC6A4SLC6A3KDM4EMEN1KMT2A
SCHEMBL6161037 0.84 MEN1 (0.54) SLC6A4SLC6A3LTA4HKDM4EMEN1
SCHEMBL6161035 0.84 MEN1 (0.54) SLC6A4SLC6A3LTA4HKDM4EMEN1
SCHEMBL6162841 0.84 CCR3 (0.53) SLC6A4SLC6A3KDM4EMEN1KMT2A
SCHEMBL3888713 0.83 MCHR1 (0.51) SLC6A4SLC6A3LTA4HKDM4ECYP2D6

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