SCHEMBL7564699

SCHEMBL7564699

CC(C)(C)[Si](C)(C)OC1CC(=CC(N)=O)c2cc(F)ccc21

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
LOX P28300 1/20 0.36
MAP3K14 Q99558 1/20 0.31
NR3C2 P08235 2/20 0.31
KIF11 P52732 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
SCHEMBL7564689 1.00 MAOA (0.36) MAOAMAOBLOXMAP3K14NR3C2
SCHEMBL7573710 0.90 KIF11 (0.33) KIF11
SCHEMBL8143402 0.90 KIF11 (0.33) KIF11
SCHEMBL7572292 0.78 ACHE (0.36) MAOBKIF11
SCHEMBL6758373 0.76 MAOA (0.43) MAOAMAOBLOXKIF11
SCHEMBL6758377 0.76 MAOA (0.43) MAOAMAOBLOXKIF11
SCHEMBL6758376 0.76 MAOA (0.43) MAOAMAOBLOXKIF11
SCHEMBL6758224 0.75 MAOA (0.46) MAOAMAOBLOXNR3C2KIF11
SCHEMBL6758222 0.75 MAOA (0.46) MAOAMAOBLOXNR3C2KIF11
SCHEMBL6758225 0.75 MAOA (0.46) MAOAMAOBLOXNR3C2KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0987248-B1 Amide derivatives and their therapeutic use WELLCOME FOUND (GB) 2002-09-04 EP disclosed
EP-0699180-B1 BICYCLIC AMIDE DERIVATIVES AND THEIR USE AS MUSCLE RELAXANTS WELLCOME FOUND (GB) 2000-11-22 EP disclosed
US-6124284-A REDUCED SIDE EFFECTS GLAXO WELLCOME INC. (US) 2000-09-26 US disclosed
EP-0987248-A1 Amide derivatives and their therapeutic use THE WELLCOME FOUNDATION LIMITED (GB) 2000-03-22 EP disclosed
US-5872118-A RELAXATION OF SKELETAL MUSCLE IN SPASTIC, HYPERTONIC AND HYPERKINETIC CONDITIONS GLAXO WELLCOME INC. (US) 1999-02-16 US disclosed
EP-0699180-A1 BICYCLIC AMIDE DERIVATIVES AND THEIR USE AS MUSCLE RELAXANTS THE WELLCOME FOUNDATION LIMITED (GB) 1996-03-06 EP disclosed
WO-1994026692-A1 BICYCLIC AMIDE DERIVATIVES AND THEIR USE AS MUSCLE RELAXANTS THE WELLCOME FOUNDATION LIMITED (GB) 1994-11-24 WO disclosed
WO-1994026693-A1 BICYCLIC AMIDE DERIVATIVES AND THEIR USE AS MUSCLE RELAXANTS THE WELLCOME FOUNDATION LIMITED (GB) 1994-11-24 WO disclosed