SCHEMBL7143750

SCHEMBL7143750

CCOc1c(C)cc(I)cc1CNCCCNc1nc2ccccc2[nH]1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.50
TRPC3 Q13507 1/20 0.50
TRPC4 Q9UBN4 1/20 0.50
TRPC5 Q9UL62 1/20 0.50
SLC2A1 P11166 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
SCHEMBL8472939 0.93 SLC2A1 (0.44) SLC2A1
SCHEMBL7214694 0.87
SCHEMBL8455189 0.82
SCHEMBL178925 0.82 BCHE (0.51) BCHETRPC3TRPC4TRPC5
SCHEMBL8215131 0.80 SLC2A1 (0.55) BCHETRPC3TRPC4TRPC5SLC2A1
Hydrochloric Acid SCHEMBL8211807 0.69 POLB (0.51)
SCHEMBL22619945 0.69 BCHE (1.00) BCHETRPC3TRPC4TRPC5
SCHEMBL10069522 0.69 SLC2A1 (0.66) BCHETRPC3TRPC4TRPC5SLC2A1
SCHEMBL178883 0.69 BCHE (0.56) BCHETRPC3TRPC4TRPC5SLC2A1
Hydrochloric Acid SCHEMBL23295188 0.68 BCHE (0.97) BCHETRPC3TRPC4TRPC5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2003500395-A 2003-01-07 JP claimed
WO-2000071522-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS METHIONYL T-RNA SYNTHETASE INHIBITORS SMITHKLINE BEECHAM PLC (GB) 2000-11-30 WO claimed
WO-2000071522-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS METHIONYL T-RNA SYNTHETASE INHIBITORS SMITHKLINE BEECHAM PLC (GB) 2000-11-30 WO disclosed