SCHEMBL5196668

SCHEMBL5196668

FC(F)(F)c1cc(Cl)nc(N2CCN(Cc3c[nH]c4ccccc34)CC2)c1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.56
DRD4 P21917 8/20 0.56
DRD3 P35462 8/20 0.56
BCHE P06276 1/20 0.56
CYP2D6 P10635 1/20 0.56
LMNA P02545 3/20 0.55
HTT P42858 3/20 0.55
POLB P06746 1/20 0.55
TSHR P16473 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.54
SRPK1 Q96SB4 2/20 0.54
HTR6 P50406 2/20 0.51
GAA P10253 1/20 0.51
KDM4E B2RXH2 1/20 0.50
MAPK1 P28482 1/20 0.50
JAK2 O60674 1/20 0.49
RAB9A P51151 1/20 0.49
HTR2A P28223 1/20 0.48
HTR7 P34969 1/20 0.48

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
SCHEMBL5196478 0.85 HTR2A (0.68) DRD2DRD4DRD3CYP2D6LMNA
SCHEMBL5196369 0.81 LMNA (0.60) DRD2DRD4DRD3BCHECYP2D6
SCHEMBL5199448 0.80 DRD2 (0.55) DRD2DRD4DRD3BCHECYP2D6
SCHEMBL5196484 0.74 BCHE (0.66) DRD2DRD4DRD3BCHECYP2D6
SCHEMBL9213113 0.74 HTR2A (0.54) DRD2DRD4DRD3LMNAHTT
SCHEMBL946337 0.74 LMNA (0.77) DRD2DRD4DRD3BCHECYP2D6
SCHEMBL12783901 0.74 BCHE (0.73) DRD2DRD4DRD3BCHECYP2D6
SCHEMBL9207839 0.73 HTR1A (0.61) DRD2L3MBTL1KDM4E
SCHEMBL2268646 0.73 AR (0.63) DRD2DRD4DRD3BCHECYP2D6
SCHEMBL5198717 0.73 DRD2 (1.00) DRD2DRD4DRD3BCHECYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1815866-A1 REMEDY OR PREVENTIVE FOR ISCHEMIC CARDIAC DISEASE OR ISCHEMIC CARDIAC MYOPATHY Neugen Pharma, Inc (JP) 2007-08-08 EP disclosed