SCHEMBL8989732

SCHEMBL8989732

Fc1ccc(C2CC3CN(CCc4ccccc4)CC32)cc1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PRCP P42785 1/20 0.44
CCR5 P51681 1/20 0.43
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
DRD2 P14416 1/20 0.41
SIGMAR1 Q99720 1/20 0.41

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
SCHEMBL7781274 0.86 HTR2A (0.45) SLC6A4DRD2SIGMAR1
SCHEMBL7078580 0.86 HRH3 (0.47) SLC6A4SLC6A3
SCHEMBL7781178 0.84 KDM1A (0.45) SLC6A4DRD2SIGMAR1
SCHEMBL7073081 0.81 GRIN2B (0.38) PRCPCCR5SLC6A4
SCHEMBL7074984 0.81 MC4R (0.44)
SCHEMBL8989718 0.81 KDM1A (0.39) SLC6A4SLC6A3DRD2
SCHEMBL7073067 0.81 KDM1A (0.39) SLC6A4SLC6A3DRD2
SCHEMBL7480872 0.81 KDM1A (0.39) SLC6A4SLC6A3DRD2
SCHEMBL7071917 0.80 KDM1A (0.51) SLC6A3DRD2SIGMAR1
SCHEMBL7781788 0.79 SLC18A3 (0.50) SLC6A4SLC6A3DRD2SIGMAR1

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-0646110-B1 N-SUBSTITUTED 3-AZABICYCLO[3.2.0]HEPTANE DERIVATIVES USEFUL AS NEUROLEPTIC AGENTS BASF AG (DE) 1996-10-23 EP disclosed
US-5521209-A N-substituted azabicyclo[3.2.0]heptane derivatives as neuroleptics, the preparation and use thereof BASF AKTIENGESELLSCHAFT (DE) 1996-05-28 US disclosed
EP-0646110-A1 N-SUBSTITUED 3-AZABICYCLO 3.2.0]HEPTANE DERIVATIVES USEFUL AS NEUROLEPTIC AGENTS ETC. BASF AG (DE) 1995-04-05 EP disclosed
WO-1994000431-A1 N-SUBSTITUED 3-AZABICYCLO[3.2.0]HEPTANE DERIVATIVES USEFUL AS NEUROLEPTIC AGENTS ETC. BASF AKTIENGESELLSCHAFT (DE) 1994-01-06 WO disclosed