SCHEMBL5199448

SCHEMBL5199448

FC(F)(F)c1cnc(N2CCN(Cc3c[nH]c4ccccc34)CC2)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.55
DRD4 P21917 5/20 0.55
DRD3 P35462 5/20 0.55
LMNA P02545 3/20 0.55
HTT P42858 3/20 0.55
GRM2 Q14416 2/20 0.55
TSHR P16473 2/20 0.55
POLB P06746 1/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
SRPK1 Q96SB4 1/20 0.54
BCHE P06276 1/20 0.54
CYP2D6 P10635 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.52
SMN1; SMN2 Q16637 4/20 0.51
ALDH1A1 P00352 3/20 0.51
MAPT P10636 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
KDM4E B2RXH2 1/20 0.50
GAA P10253 1/20 0.49

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
SCHEMBL5197306 0.86 HTR2A (0.67) DRD2DRD4DRD3LMNAGRM2
SCHEMBL5196369 0.81 LMNA (0.60) DRD2DRD4DRD3LMNAHTT
SCHEMBL5196668 0.80 DRD2 (0.56) DRD2DRD4DRD3LMNAHTT
SCHEMBL4244132 0.79 MEN1 (0.56) DRD2DRD4DRD3LMNAHTT
SCHEMBL4251327 0.74 SMN1; SMN2 (0.62) DRD2DRD4DRD3LMNAHTT
SCHEMBL8328575 0.74 DRD4 (0.68) DRD2DRD4DRD3LMNATSHR
SCHEMBL946337 0.72 LMNA (0.77) DRD2DRD4DRD3LMNAHTT
SCHEMBL4254154 0.72 SMN1; SMN2 (0.51) DRD2DRD4DRD3LMNAHTT
SCHEMBL12783901 0.72 BCHE (0.73) DRD2DRD4DRD3LMNAHTT
SCHEMBL24606221 0.71 GRM2 (1.00) DRD2DRD4DRD3LMNAGRM2

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