SCHEMBL6993145

SCHEMBL6993145

C=C(O)CCC1Oc2cccc(OC)c2-c2ccc3c(c21)C(C)=CC(C)(C)N3

nearest known ligand 0.80

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 20/20 0.80
▸ PGR P06401 3/20 0.77
▸ AR P10275 1/20 0.74

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
SCHEMBL4179279 0.93 NR3C1 (0.83) NR3C1PGRAR
SCHEMBL4175015 0.89 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL4177039 0.89 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL4172432 0.87 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL4170287 0.87 NR3C1 (0.89) NR3C1PGRAR
SCHEMBL4175254 0.87 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL4169380 0.87 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL4176522 0.87 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL4180878 0.87 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL4180622 0.86 NR3C1 (1.00) NR3C1PGRAR

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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