SCHEMBL5953768

SCHEMBL5953768

CCCc1c(OCCC(C)(C)C(N)=O)ccc2c(C(F)(F)F)noc12

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR1H3 Q13133 15/20 0.65
NR1H2 P55055 13/20 0.65
PPARG P37231 9/20 0.64
PPARA Q07869 7/20 0.64
PPARD Q03181 6/20 0.64

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
SCHEMBL5953868 0.88 NR1H3 (0.69) NR1H3NR1H2PPARGPPARAPPARD
SCHEMBL5807237 0.84 GRM2 (0.56) NR1H3NR1H2PPARGPPARAPPARD
SCHEMBL6371470 0.83 NR1H3 (0.75) NR1H3NR1H2PPARGPPARAPPARD
SCHEMBL6349256 0.83 NR1H3 (0.70) NR1H3NR1H2PPARGPPARAPPARD
SCHEMBL6168918 0.83 NR1H3 (0.68) NR1H3NR1H2PPARGPPARAPPARD
SCHEMBL6099414 0.82 NR1H3 (0.69) NR1H3NR1H2PPARGPPARAPPARD
SCHEMBL1400270 0.82 NR1H3 (0.66) NR1H3NR1H2PPARGPPARAPPARD
SCHEMBL5953874 0.81 NR1H3 (0.66) NR1H3NR1H2PPARGPPARAPPARD
SCHEMBL6366557 0.81 NR1H3 (0.67) NR1H3NR1H2PPARGPPARAPPARD
SCHEMBL6175211 0.81 NR1H3 (0.66) NR1H3NR1H2PPARGPPARAPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060020036-A1 Methods and compositions to promote bone homestasis GALAPAGOS N.V. (BE) 2006-01-26 US disclosed