SCHEMBL7092892

SCHEMBL7092892

CC1=CC(C)(C)Nc2ccc3c(c21)C(c1cc(Cl)cc(Cl)c1)Oc1ccccc1-3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 20/20 1.00
▸ NR3C1 P04150 15/20 1.00
▸ AR P10275 13/20 1.00
▸ NR3C2 P08235 11/20 0.86
▸ ESR1 P03372 10/20 0.86
▸ ESR2 Q92731 10/20 0.86

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
SCHEMBL6650996 0.92 PGR (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL6648377 0.87 PGR (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL6294460 0.87 NR3C1 (0.81) PGRNR3C1ARNR3C2ESR1
SCHEMBL8146749 0.86 PGR (0.82) PGRNR3C1ARNR3C2ESR1
SCHEMBL6295018 0.84 PGR (0.74) PGRNR3C1ARNR3C2ESR1
SCHEMBL4167703 0.84 NR3C1 (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL6290341 0.84 NR3C1 (0.74) PGRNR3C1ARNR3C2ESR1
SCHEMBL8015600 0.84 PGR (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL6648200 0.83 PGR (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL6650300 0.83 PGR (1.00) PGRNR3C1ARNR3C2ESR1

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 3 patents. 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
EP-1299392-A2 GLUCOCORTIOCOID-SELECTIVE ANTIINFLAMMATORY AGENTS Abbott Laboratories (US) 2003-04-09 — — EP disclosed
WO-2002002565-A2 GLUCOCORTIOCOID-SELECTIVE ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES (US) 2002-01-10 — — WO disclosed
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