SCHEMBL6995508

SCHEMBL6995508

COC(=O)Oc1cccc(C2Oc3cccc(OC)c3-c3ccc4c(c32)C(C)=CC(C)(C)N4)c1

nearest known ligand 0.84

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 20/20 0.84
▸ NR3C2 P08235 4/20 0.84
▸ AR P10275 4/20 0.84
▸ PGR P06401 6/20 0.71

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
SCHEMBL6291683 0.93 NR3C1 (0.85) NR3C1NR3C2ARPGR
SCHEMBL6290346 0.92 NR3C1 (0.81) NR3C1NR3C2ARPGR
SCHEMBL4170351 0.91 NR3C1 (1.00) NR3C1NR3C2ARPGR
SCHEMBL4172146 0.91 NR3C1 (0.84) NR3C1NR3C2ARPGR
SCHEMBL7002840 0.90 NR3C1 (0.78) NR3C1NR3C2ARPGR
SCHEMBL7090951 0.89 NR3C1 (0.87) NR3C1NR3C2ARPGR
SCHEMBL6291726 0.88 NR3C1 (0.82) NR3C1NR3C2ARPGR
SCHEMBL4176764 0.86 NR3C1 (0.88) NR3C1NR3C2ARPGR
SCHEMBL4178899 0.86 NR3C1 (1.00) NR3C1NR3C2ARPGR
SCHEMBL4180749 0.86 NR3C1 (0.80) NR3C1NR3C2ARPGR

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
EP-1053239-B1 GLUCOCORTICOID-SELECTIVE ANTI-INFLAMMATORY AGENTS ABBOTT LAB (US) 2003-01-08 — — EP claimed
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