SCHEMBL8747895

SCHEMBL8747895

COC12CCC(c3ccc(COC(C)(C)C(=O)O)cc3)(CC1)CC2

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 19/20 0.43
SLC16A1 P53985 16/20 0.43
MCTS1 Q9ULC4 8/20 0.43

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
Hydrochloric Acid SCHEMBL9244003 0.99 SLC16A3 (0.42) SLC16A3SLC16A1MCTS1
SCHEMBL9243997 0.88 SLC16A3 (0.35) SLC16A3SLC16A1MCTS1
SCHEMBL9244843 0.88 SLC16A3 (0.37) SLC16A3SLC16A1MCTS1
SCHEMBL9251152 0.87 SLC16A3 (0.41) SLC16A3SLC16A1MCTS1
SCHEMBL9245590 0.87 PPARA (0.38) SLC16A3SLC16A1MCTS1
SCHEMBL9248983 0.86 SLC16A3 (0.39) SLC16A3SLC16A1MCTS1
SCHEMBL9245024 0.86 SLC16A3 (0.41) SLC16A3SLC16A1MCTS1
SCHEMBL9247301 0.86 ADORA3 (0.43) SLC16A3SLC16A1MCTS1
SCHEMBL9248341 0.85 SLC16A3 (0.41) SLC16A3SLC16A1MCTS1
SCHEMBL9247121 0.85 SLC16A3 (0.46) SLC16A3SLC16A1MCTS1

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 6 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 claimed
US-5403953-A Antiarthritic and -inflammatory agents ADIR ET COMPAGNIE (FR) 1995-04-04 US claimed
JP-6228044-A None JP disclosed
US-5403953-A Antiarthritic and -inflammatory agents ADIR ET COMPAGNIE (FR) 1995-04-04 US disclosed
JP-H06228044-A NEW 1-PHENYLBICYCLO(2,2,2)OCTANE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITION CONTAINING THESE DERIVATIVES ADIR 1994-08-16 JP 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