SCHEMBL4182419

SCHEMBL4182419

CC1=CC(C)(C)Nc2ccc3c(c21)C(c1ccccc1)Oc1cccc(OC(F)F)c1-3

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 17/20 0.79
▸ AR P10275 7/20 0.79
▸ NR3C2 P08235 6/20 0.79
▸ PGR P06401 10/20 0.68
▸ ESR1 P03372 2/20 0.67
▸ ESR2 Q92731 2/20 0.67

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
SCHEMBL4171493 0.89 NR3C1 (1.00) NR3C1ARNR3C2PGRESR1
SCHEMBL4183004 0.86 NR3C1 (0.78) NR3C1ARNR3C2PGRESR1
SCHEMBL4172900 0.86 NR3C1 (0.83) NR3C1ARNR3C2PGRESR1
SCHEMBL4174333 0.86 NR3C1 (0.81) NR3C1ARNR3C2PGRESR1
SCHEMBL6294953 0.85 NR3C1 (0.80) NR3C1ARNR3C2PGRESR1
SCHEMBL6291028 0.85 NR3C1 (0.79) NR3C1ARNR3C2PGRESR1
SCHEMBL7139950 0.85 NR3C1 (0.79) NR3C1ARNR3C2PGRESR1
SCHEMBL4174569 0.85 PGR (0.63) NR3C1ARNR3C2PGRESR1
SCHEMBL6290327 0.84 PGR (0.78) NR3C1ARNR3C2PGRESR1
SCHEMBL6291073 0.84 NR3C1 (0.63) NR3C1ARNR3C2PGR

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030073703-A1 Glucocortiocoid-selective antinflammatory agents ABBOTT LABORATORIES AND LIGAND PHARMACEUTICALS INCORPORATED 2003-04-17 — — US claimed
US-6506766-B1 A pharmaceutical composition for use in treating inflammation, immune, autoimmune, and inflammatory diseases in a mammal by selectively modulating the activation, repression, agonism, and antagonism effects of the mammal's glucocorticoid ABBOTT LABORATORIES 2003-01-14 — — US claimed
EP-1053239-B1 GLUCOCORTICOID-SELECTIVE ANTI-INFLAMMATORY AGENTS ABBOTT LAB (US) 2003-01-08 — — EP claimed
US-20090227571-A1 Androgen Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED 2009-09-10 — — US disclosed
US-6951942-B2 Glucocorticoid-selective anti-inflammatory agents ABBOTT LABORATORIES (US) 2005-10-04 — — US disclosed
US-20030073703-A1 Glucocortiocoid-selective antinflammatory agents ABBOTT LABORATORIES AND LIGAND PHARMACEUTICALS INCORPORATED 2003-04-17 — — US disclosed
US-6506766-B1 A pharmaceutical composition for use in treating inflammation, immune, autoimmune, and inflammatory diseases in a mammal by selectively modulating the activation, repression, agonism, and antagonism effects of the mammal's glucocorticoid ABBOTT LABORATORIES 2003-01-14 — — US disclosed
EP-1053239-B1 GLUCOCORTICOID-SELECTIVE ANTI-INFLAMMATORY AGENTS ABBOTT LAB (US) 2003-01-08 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090227571-A1 Androgen Receptor Modulator Compounds and Methods AR, NR5A1, ESRRA NR3C1 21/4885AR 1/4885NR3C2 12/4885
US-20030073703-A1 Glucocortiocoid-selective antinflammatory agents NR3C1, GPR119, MC2R NR3C1 1/4885AR 1816/4885NR3C2 11/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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