SCHEMBL8760562

SCHEMBL8760562

N#Cc1ccccc1N1CCN(C(Cl)C=O)CC1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.43
DRD4 P21917 5/20 0.43
GRM5 P41594 1/20 0.43
DRD3 P35462 3/20 0.43
MC4R P32245 1/20 0.42
HTR1A P08908 4/20 0.41
HTR7 P34969 2/20 0.41
AR P10275 1/20 0.41
ADRA1A P35348 2/20 0.40
ADRA1B P35368 2/20 0.40
ADRA1D P25100 1/20 0.40
HSP90AB1 P08238 1/20 0.38
TACR3 P29371 1/20 0.38
DPP4 P27487 1/20 0.38

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
SCHEMBL3088832 0.79 DRD4 (0.54) DRD2DRD4GRM5DRD3HTR1A
SCHEMBL2321076 0.78 DRD4 (0.49) DRD2DRD4GRM5DRD3HTR1A
SCHEMBL13898671 0.76 MC4R (0.51) DRD2DRD4GRM5DRD3MC4R
SCHEMBL2321072 0.74 DRD4 (0.49) DRD2DRD4GRM5DRD3HTR1A
SCHEMBL23277098 0.74 KDM4E (0.58) DRD2DRD4GRM5DRD3HTR1A
SCHEMBL20156961 0.74 DRD2 (0.49) DRD2DRD4GRM5DRD3MC4R
SCHEMBL20156862 0.72 DRD2 (0.45) DRD2DRD4GRM5DRD3MC4R
SCHEMBL30406641 0.71 AR (0.59) DRD2DRD4GRM5DRD3HTR1A
SCHEMBL829177 0.71 AR (0.65) DRD2DRD4GRM5HTR1AAR
SCHEMBL2077260 0.71 GRM5 (0.51) DRD2DRD4GRM5DRD3HTR1A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0773937-A1 NOVEL ARYL PIPERAZINE-DERIVED PIPERAZIDE DERIVATIVES, METHODS FOR THEIR PREPARATION, THEIR USE AS DRUGS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME PIERRE FABRE MEDICAMENT (FR) 1997-05-21 EP disclosed
WO-1996002525-A1 NOVEL ARYL PIPERAZINE-DERIVED PIPERAZIDE DERIVATIVES, METHODS FOR THEIR PREPARATION, THEIR USE AS DRUGS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME PIERRE FABRE MEDICAMENT (FR) 1996-02-01 WO disclosed