SCHEMBL9011936

SCHEMBL9011936

CNc1ccccc1C[S+]([O-])c1nc2c([nH]1)CCCC2

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 1/20 0.33
ATP4B P51164 1/20 0.33
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
AR P10275 1/20 0.31
SMPD3 Q9NY59 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL9011927 0.85 KDM4E (0.32) HPGD
SCHEMBL9012381 0.81 CHRNE (0.33) ATP4AATP4B
SCHEMBL9012107 0.81 ACHE (0.35) ATP4AATP4BARHPGD
SCHEMBL6476005 0.75 ATP4A (0.52) ATP4AATP4BLMNA
Water SCHEMBL6481932 0.74 ATP4A (0.51) ATP4AATP4BLMNA
SCHEMBL9011928 0.73 AR (0.34) ATP4AATP4BAR
SCHEMBL6481930 0.73 HPGD (0.51) LMNAHTTHPGD
SCHEMBL9693721 0.71 PDE5A (0.42) ATP4AATP4BLMNAHPGD
SCHEMBL9011990 0.71 AR (0.34) ATP4AATP4BAR
SCHEMBL22408462 0.70 KDM4E (0.42) SMPD3HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5523317-A ADMINISTERING IMIDAZOLE DERIVATIVE NIPPON CHEMIPHAR CO., LTD. (JP) 1996-06-04 US disclosed
EP-0354788-B1 Novel imidazole derivatives NIPPON CHEMIPHAR CO (JP) 1995-09-13 EP disclosed
EP-0633026-A1 Use of imidazole derivative for antihypertensive agent NIPPON CHEMIPHAR CO., LTD. (JP) 1995-01-11 EP disclosed
EP-0584588-A1 Anti-ulcer composition containing imidazole derivative NIPPON CHEMIPHAR CO., LTD. (JP) 1994-03-02 EP disclosed
US-5180836-A Antiulcer agents NIPPON CHEMIPHAR CO., LTD. (JP) 1993-01-19 US disclosed
US-5082943-A Antiulcer NIPPON CHEMIPHAR CO., LTD. (JP) 1992-01-21 US disclosed
EP-0354788-A1 Novel imidazole derivatives NIPPON CHEMIPHAR CO., LTD. (JP) 1990-02-14 EP disclosed