SCHEMBL7723133

SCHEMBL7723133

c1ccc(Oc2ccccc2C2CCN(CC3(c4ccccc4)CC3)CC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 4/20 0.50
SLC6A2 P23975 4/20 0.50
SLC6A4 P31645 4/20 0.50
SLC6A3 Q01959 4/20 0.50
MEN1 O00255 7/20 0.45
KMT2A Q03164 7/20 0.45
DRD2 P14416 2/20 0.43
KDM1A O60341 2/20 0.40
OPRM1 P35372 1/20 0.39
ATM Q13315 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GRM2 Q14416 1/20 0.35

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
SCHEMBL6161129 0.77 HTR1A (0.52) HTR1ASLC6A2SLC6A4SLC6A3MEN1
SCHEMBL8211064 0.74 CACNA1G (0.39) MEN1KMT2A
SCHEMBL13898484 0.72 SIGMAR1 (0.47) HTR1AMEN1KMT2ADRD2
SCHEMBL7723129 0.72 DRD2 (0.50) HTR1ASLC6A2SLC6A4SLC6A3MEN1
SCHEMBL6159547 0.71 PARK7 (0.36) HTR1ASLC6A4MEN1KMT2AOPRM1
SCHEMBL13898515 0.70 OPRL1 (0.51) MEN1KMT2ADRD2OPRM1
SCHEMBL7598684 0.70 HTR1A (0.70) HTR1ASLC6A2SLC6A4SLC6A3MEN1
SCHEMBL6159481 0.70 OPRL1 (0.44) OPRM1
SCHEMBL6161715 0.69 SLC6A2 (0.46) HTR1ASLC6A2SLC6A4SLC6A3DRD2
SCHEMBL6159478 0.69 SLC18A3 (0.47) DRD2

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
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