SCHEMBL6997662

SCHEMBL6997662

C=CCC1Oc2cccc(OC(=O)O)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 11/20 0.80
▸ AR P10275 8/20 0.80

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
Al-43 SCHEMBL29364100 0.89 NR3C1 (1.00) NR3C1PGRAR
Al-43 SCHEMBL4172433 0.89 NR3C1 (1.00) NR3C1PGRAR
Al-43 SCHEMBL7110788 0.89 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL6291142 0.88 NR3C1 (0.82) NR3C1PGRAR
SCHEMBL4165174 0.86 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL7113976 0.86 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL6291740 0.86 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL4167709 0.86 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL7113960 0.86 NR3C1 (0.74) NR3C1PGRAR
SCHEMBL7113954 0.86 NR3C1 (0.74) 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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