SCHEMBL9247331

SCHEMBL9247331

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

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.31
HSD11B1 P28845 1/20 0.31
ADORA3 P0DMS8 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
SCHEMBL9246492 0.83 TSHR (0.34)
SCHEMBL9250285 0.74 CA1 (0.44)
SCHEMBL8747895 0.73 SLC16A3 (0.43)
SCHEMBL9247301 0.73 ADORA3 (0.43) ADORA3
SCHEMBL8747723 0.72 HSD11B1 (0.32) HSD11B1ADORA3
Hydrochloric Acid SCHEMBL9244003 0.72 SLC16A3 (0.42)
SCHEMBL9245590 0.71 PPARA (0.38)
SCHEMBL9248972 0.71 CA2 (0.42) HSD11B1
SCHEMBL2231434 0.69 KMT2A (0.46)
SCHEMBL9248163 0.69 SLC16A3 (0.38) HSD11B1ADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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