SCHEMBL8747723

SCHEMBL8747723

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

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
SLC22A12 Q96S37 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
SCHEMBL9247517 0.85 OPRM1 (0.32)
SCHEMBL8747895 0.78 SLC16A3 (0.43)
Hydrochloric Acid SCHEMBL9244003 0.77 SLC16A3 (0.42)
SCHEMBL9248972 0.76 CA2 (0.42) HSD11B1
SCHEMBL9245590 0.76 PPARA (0.38)
SCHEMBL9247301 0.75 ADORA3 (0.43) ADORA3
SCHEMBL9248163 0.73 SLC16A3 (0.38) HSD11B1ADORA3
SCHEMBL5757662 0.73 LDHA (0.49) SLC22A12
SCHEMBL9247331 0.72 PGR (0.31) HSD11B1ADORA3
Hydrochloric Acid SCHEMBL6574400 0.72 IDO1 (0.49) SLC22A12

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