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SCHEMBL4128078

SCHEMBL4128078

COc1cc(F)ccc1C(C)(C)CC(O)(Cc1ccccc1F)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 19/20 0.59
▸ NR3C2 P08235 13/20 0.59
▸ PGR P06401 8/20 0.43

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
SCHEMBL4039578 0.91 NR3C1 (0.71) NR3C1NR3C2PGR
SCHEMBL4138205 0.84 NR3C1 (0.61) NR3C1NR3C2PGR
SCHEMBL27774909 0.83 NR3C1 (0.54) NR3C1NR3C2PGR
SCHEMBL4122397 0.83 NR3C1 (0.51) NR3C1NR3C2PGR
SCHEMBL3657951 0.83 NR3C1 (0.59) NR3C1NR3C2PGR
SCHEMBL3656612 0.82 NR3C1 (0.72) NR3C1NR3C2PGR
SCHEMBL4128075 0.81 NR3C1 (0.46) NR3C1NR3C2PGR
SCHEMBL4142575 0.81 NR3C1 (0.72) NR3C1NR3C2PGR
SCHEMBL4120626 0.81 NR3C1 (0.72) NR3C1NR3C2PGR
SCHEMBL4138451 0.81 NR3C1 (0.58) NR3C1NR3C2PGR

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
EP-2049112-A2 TREATING INFECTIONS AND SEQUELAE THEREOF WITH COMBINED DISSOCIATED GLUCOCORTICOID RECEPTOR AGONISTS AND ANTI-INFECTIVE AGENTS Bausch & Lomb Incorporated (US) 2009-04-22 — — EP disclosed
WO-2008021728-A2 TREATING INFECTIONS AND SEQUELAE THEREOF WITH COMBINED DISSOCIATED' GLUCOCORTICOID RECEPTOR AGONISTS AND ANTI-INFECTIVE AGENTS BAUSCH & LOMB INCORPORATED (US) 2008-02-21 — — WO disclosed