SCHEMBL8359374

SCHEMBL8359374

O=C(O)/C=C1\CCc2c(Cl)cc(F)cc21

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.54
MAOB P27338 1/20 0.54
LOX P28300 1/20 0.54
NOTUM Q6P988 5/20 0.50
IDO1 P14902 1/20 0.33
IDH1 O75874 6/20 0.32
TRPA1 O75762 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
HTR5A P47898 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
SCHEMBL8359378 1.00 MAOA (0.54) MAOAMAOBLOXNOTUMIDO1
SCHEMBL8359381 1.00 MAOA (0.54) MAOAMAOBLOXNOTUMIDO1
SCHEMBL8361249 0.88 MAOA (0.54) MAOAMAOBLOXNOTUMIDO1
SCHEMBL8361250 0.88 MAOA (0.54) MAOAMAOBLOXNOTUMIDO1
SCHEMBL8361252 0.88 MAOA (0.54) MAOAMAOBLOXNOTUMIDO1
SCHEMBL6757148 0.86 MAOA (0.73) MAOAMAOBLOXNOTUMIDO1
SCHEMBL6757144 0.86 MAOA (0.73) MAOAMAOBLOXNOTUMIDO1
SCHEMBL6757146 0.86 MAOA (0.73) MAOAMAOBLOXNOTUMIDO1
SCHEMBL7566326 0.84 MAOA (0.74) MAOAMAOBLOXNOTUMIDO1
SCHEMBL8361268 0.84 NOTUM (0.48) MAOAMAOBLOXNOTUMIDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0759026-B1 AMIDE DERIVATIVES AND THEIR THERAPEUTIC USE WELLCOME FOUND (GB) 1999-08-18 EP claimed
US-5708033-A ANTIINFLAMMATORY AGENTS, ANTIARTHRITIC AGENTS OR ANALGESICS GLAXO WELLCOME INC. (US) 1998-01-13 US claimed
EP-0759026-A1 AMIDE DERIVATIVES AND THEIR THERAPEUTIC USE THE WELLCOME FOUNDATION LIMITED (GB) 1997-02-26 EP claimed
WO-1995030645-A1 AMIDE DERIVATIVES AND THEIR THERAPEUTIC USE THE WELLCOME FOUNDATION LIMITED (GB) 1995-11-16 WO claimed
EP-0759026-B1 AMIDE DERIVATIVES AND THEIR THERAPEUTIC USE WELLCOME FOUND (GB) 1999-08-18 EP disclosed
US-5708033-A ANTIINFLAMMATORY AGENTS, ANTIARTHRITIC AGENTS OR ANALGESICS GLAXO WELLCOME INC. (US) 1998-01-13 US disclosed
EP-0759026-A1 AMIDE DERIVATIVES AND THEIR THERAPEUTIC USE THE WELLCOME FOUNDATION LIMITED (GB) 1997-02-26 EP disclosed
WO-1995030645-A1 AMIDE DERIVATIVES AND THEIR THERAPEUTIC USE THE WELLCOME FOUNDATION LIMITED (GB) 1995-11-16 WO disclosed
WO-1994026692-A1 BICYCLIC AMIDE DERIVATIVES AND THEIR USE AS MUSCLE RELAXANTS THE WELLCOME FOUNDATION LIMITED (GB) 1994-11-24 WO disclosed