SCHEMBL6233063

SCHEMBL6233063

Cc1ccccc1Nc1cc(Nc2ccc(Cl)c(Cl)c2)c2ccccc2n1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 2/20 0.71
NPY5R Q15761 1/20 0.48
TP53 P04637 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MAPT P10636 5/20 0.46
LMNA P02545 2/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
MEN1 O00255 2/20 0.46
RAB9A P51151 2/20 0.46
KMT2A Q03164 2/20 0.46
NPC1 O15118 1/20 0.46
PKM P14618 1/20 0.46
MAPK13 O15264 1/20 0.45
MAPK12 P53778 1/20 0.45
MAPK11 Q15759 1/20 0.45
MAPK14 Q16539 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
ACP1 P24666 1/20 0.44

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
SCHEMBL6236745 0.88 SLC2A1 (0.54) SLC2A1NPY5RTP53SMN1; SMN2MAPT
SCHEMBL6238037 0.86 NPY5R (0.60) SLC2A1NPY5RTP53SMN1; SMN2MAPT
SCHEMBL6235106 0.86 SMN1; SMN2 (0.69) SLC2A1TP53SMN1; SMN2MAPTLMNA
SCHEMBL6230099 0.85 L3MBTL1 (0.51) SLC2A1NPY5RTP53SMN1; SMN2MAPT
SCHEMBL6233775 0.85 SLC2A1 (0.50) SLC2A1NPY5RTP53SMN1; SMN2MAPT
SCHEMBL6234079 0.85 SLC2A1 (0.50) SLC2A1NPY5RTP53SMN1; SMN2MAPT
SCHEMBL6233225 0.85 POLB (0.51) SLC2A1NPY5RTP53SMN1; SMN2MAPT
SCHEMBL6231640 0.83 SLC2A1 (0.48) SLC2A1NPY5RTP53SMN1; SMN2MAPT
SCHEMBL6091625 0.79 NPY5R (0.57) SLC2A1NPY5RTP53SMN1; SMN2MEN1
SCHEMBL6231576 0.77 NCF1 (0.46) SLC2A1SMN1; SMN2MAPTLMNAGAA

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-1430030-B1 N-TYPE CALCIUM CHANNEL ANTAGONISTS FOR THE TREATMENT OF PAIN ASTRAZENECA AB (SE) 2005-05-18 EP disclosed