SCHEMBL7723129

SCHEMBL7723129

c1ccc(Oc2ccccc2C2CCN(C[C@@H]3C[C@H]3c3ccccc3)CC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.50
DRD4 P21917 11/20 0.50
SLC6A2 P23975 4/20 0.49
SLC6A4 P31645 4/20 0.49
SLC6A3 Q01959 4/20 0.49
HTR1A P08908 1/20 0.49
CCR5 P51681 2/20 0.47
KDM1A O60341 2/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL6161120 0.79 DRD2 (0.74) DRD2DRD4
SCHEMBL6160574 0.74 SLC6A2 (0.53) DRD2DRD4SLC6A2SLC6A4SLC6A3
SCHEMBL13898517 0.74 CCR5 (0.60) DRD2DRD4CCR5
SCHEMBL3892595 0.74 CCR5 (0.60) DRD2DRD4CCR5
SCHEMBL6161706 0.72 DRD2 (0.78) DRD2DRD4
SCHEMBL7723133 0.72 HTR1A (0.50) DRD2SLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL445421 0.71 DRD2 (0.69) DRD2DRD4
SCHEMBL8211043 0.71 SLC6A2 (0.57) DRD2DRD4SLC6A2SLC6A4SLC6A3
SCHEMBL5363060 0.71 DRD2 (0.60) DRD2DRD4SLC6A2SLC6A4SLC6A3
SCHEMBL6160819 0.71 DRD2 (0.55) DRD2DRD4SLC6A2SLC6A4SLC6A3

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