SCHEMBL6160819

SCHEMBL6160819

Cc1cc(-c2ccc(F)cc2)ccc1C1CCN(C[C@@H]2C[C@H]2c2ccccc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 13/20 0.55
DRD4 P21917 11/20 0.55
SLC6A2 P23975 4/20 0.49
SLC6A4 P31645 4/20 0.49
SLC6A3 Q01959 4/20 0.49
OPRM1 P35372 1/20 0.48
OPRL1 P41146 1/20 0.48
KCNH2 Q12809 1/20 0.48
CCR5 P51681 1/20 0.45
HTR2C P28335 1/20 0.45

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
SCHEMBL13898517 0.76 CCR5 (0.60) DRD2DRD4CCR5
SCHEMBL3892595 0.76 CCR5 (0.60) DRD2DRD4CCR5
SCHEMBL6159534 0.76 SLC6A2 (0.53) DRD2DRD4SLC6A2SLC6A4SLC6A3
SCHEMBL6160574 0.76 SLC6A2 (0.53) DRD2DRD4SLC6A2SLC6A4SLC6A3
SCHEMBL6159481 0.75 OPRL1 (0.44) DRD4OPRM1OPRL1KCNH2
SCHEMBL6158951 0.75 MEN1 (0.51) DRD2SLC6A2SLC6A4SLC6A3OPRM1
SCHEMBL6159875 0.75 HTR2A (0.54) DRD2DRD4SLC6A4SLC6A3OPRM1
SCHEMBL6162587 0.75 KDM4E (0.47) OPRM1OPRL1KCNH2
SCHEMBL6158959 0.75 MEN1 (0.51) DRD2SLC6A2SLC6A4SLC6A3OPRM1
SCHEMBL8211043 0.75 SLC6A2 (0.57) 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
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