SCHEMBL9011897

SCHEMBL9011897

CC(C)CNc1ccc(OC(F)(F)F)cc1C[S+]([O-])c1ncc[nH]1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
TLR7 Q9NYK1 1/20 0.32
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31

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
SCHEMBL9011890 0.88 ADRA1D (0.40) NPC1RAB9A
SCHEMBL6528639 0.79 IDO1 (0.33) TLR7
SCHEMBL9011898 0.78 NPC1 (0.34) NPC1RAB9ATLR7PDE3BPDE3A
SCHEMBL9012164 0.78 RIPK1 (0.44) NPC1RAB9A
SCHEMBL9011960 0.76 ITK (0.30)
SCHEMBL9329176 0.73 ADRA1D (0.40)
SCHEMBL9012410 0.72 HTR1A (0.32)
SCHEMBL9011980 0.71 ADRA1D (0.38) RAB9APDE3BPDE3A
SCHEMBL9012324 0.71 PDE3B (0.31) PDE3BPDE3A
SCHEMBL9012474 0.70 ADRA1A (0.35)

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