SCHEMBL8748101

SCHEMBL8748101

CCN(CC)C(=O)COC(=O)C(C)(C)OCc1ccc(C23CCC(OC)(CC2)CC3)cc1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.32
TRPM8 Q7Z2W7 2/20 0.30
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
APP P05067 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
SCHEMBL8748098 0.88 ALDH1A1 (0.34) ALDH1A1TRPM8NPC1LMNAMAPT
SCHEMBL9247502 0.88 PPARA (0.36)
SCHEMBL8747895 0.79 SLC16A3 (0.43)
Hydrochloric Acid SCHEMBL9244003 0.78 SLC16A3 (0.42)
SCHEMBL9244843 0.78 SLC16A3 (0.37)
SCHEMBL9243997 0.78 SLC16A3 (0.35) ALDH1A1
SCHEMBL9246981 0.76 PPARA (0.39) ALDH1A1LMNAMAPT
SCHEMBL9247301 0.74 ADORA3 (0.43)
SCHEMBL9251152 0.72 SLC16A3 (0.41)
SCHEMBL9248163 0.72 SLC16A3 (0.38)

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
EP-0599732-B1 Derivatives of 1-phenylbicyclo-2,2,2-octane, their preparation process and pharmaceutical compositions containing them ADIR (FR) 1997-03-12 EP disclosed
US-5403953-A Antiarthritic and -inflammatory agents ADIR ET COMPAGNIE (FR) 1995-04-04 US disclosed
EP-0599732-A1 Derivatives of 1-phenylbicyclo-2,2,2-octane, their preparation process and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1994-06-01 EP disclosed