SCHEMBL4455578

SCHEMBL4455578

CCCCCCCCCCCCOC(=O)O[C@]1(C(=O)CO)[C@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C

nearest known ligand 0.80

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 17/20 0.80
▸ PGR P06401 4/20 0.80
▸ MEN1 O00255 1/20 0.80
▸ USP2 O75604 1/20 0.80
▸ CYP3A4 P08684 1/20 0.80
▸ KMT2A Q03164 1/20 0.80
▸ MMP1 P03956 15/20 0.77
▸ NR1I2 O75469 1/20 0.67
▸ ADORA3 P0DMS8 1/20 0.67
▸ DRD2 P14416 1/20 0.67
▸ OPRD1 P41143 1/20 0.67
▸ MAPT P10636 1/20 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
SCHEMBL11156674 0.99 NR3C1 (0.81) NR3C1PGRMEN1USP2CYP3A4
SCHEMBL11152776 0.97 NR3C1 (0.82) NR3C1PGRMEN1USP2CYP3A4
SCHEMBL11162374 0.94 NR3C1 (0.79) NR3C1PGRMEN1USP2CYP3A4
SCHEMBL11433058 0.93 NR3C1 (0.74) NR3C1PGRMEN1USP2CYP3A4
SCHEMBL11424740 0.92 NR3C1 (0.73) NR3C1PGRMEN1USP2CYP3A4
SCHEMBL7205322 0.92 NR3C1 (0.69) NR3C1PGRMEN1USP2CYP3A4
SCHEMBL11421450 0.91 NR3C1 (0.72) NR3C1PGRMEN1USP2CYP3A4
SCHEMBL7595137 0.91 NR3C1 (0.80) NR3C1PGRMEN1USP2CYP3A4
SCHEMBL11422072 0.91 NR3C1 (0.82) NR3C1PGRMEN1USP2CYP3A4
SCHEMBL11439432 0.91 NR3C1 (0.71) NR3C1PGRMEN1USP2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8710036-B2 Carbonate and carbamate modified forms of glucocorticoids in combination with β2 adrenergic agonists SUNOVION PHARMACEUTICALS INC. (US) 2014-04-29 — — US disclosed
US-20130244988-A1 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS IN COMBINATION WITH B2 ADRENERGIC AGONISTS SUNOVION PHARMACEUTICALS INC. (US) 2013-09-19 — — US disclosed
US-8445470-B2 Carbonate and carbamate modified forms of glucocorticoids in combination with B2 adrenergic agonists SUNOVION PHARMACEUTICALS INC. (US) 2013-05-21 — — US disclosed
US-20090163456-A1 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS IN COMBINATION WITH B2 ADRENERGIC AGONISTS SEPRACOR INC. (US) 2009-06-25 — — US disclosed
US-7468362-B2 Carbonate and carbamate modified forms of glucocorticoids in combination with β2 adrenergic agonists SEPRACOR INC. (US) 2008-12-23 — — US disclosed
US-20080103119-A1 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS IN COMBINATION WITH B2 ADRENERGIC AGONISTS SEPRACOR INC. (US) 2008-05-01 — — US disclosed
US-7253156-B2 Carbonate and carbamate modified forms of glucocorticoids in combination with B2 adrenergic agonists SEPRACOR INC. (US) 2007-08-07 — — US disclosed
US-20060148775-A1 Carbonate and carbamate modified forms of glucocorticoids in combination with B2 adrenergic agonists SEPRACOR INC. (US) 2006-07-06 — — US disclosed
US-7018995-B2 Carbonate and carbamate modified forms of glucocorticoids SEPRACOR INC. (US) 2006-03-28 — — US disclosed
US-20050009798-A1 Carbonate and carbamate modified forms of glucocorticoids in combination with B2 adrenergic agonists SEPRACOR INC. (US) 2005-01-13 — — US disclosed
WO-2004047845-A1 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS IN COMBINATION WITH β2 ADRENERGIC AGONISTS SEPRACOR INC. (US) 2004-06-10 — — WO disclosed
WO-2003070745-A2 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS SEPRACOR INC. (US) 2003-08-28 — — WO 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 (5 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-20060148775-A1 Carbonate and carbamate modified forms of glucocorticoids in combination with B2 adrenergic agonists ADRB2, ADRA2C, NR3C2 NR3C1 12/4885PGR 449/4885MEN1 1765/4885
US-20080103119-A1 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS IN COMBINATION WITH B2 ADRENERGIC AGONISTS ADRB2, ADRA2C, NR3C2 NR3C1 12/4885PGR 449/4885MEN1 1765/4885
US-20130244988-A1 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS IN COMBINATION WITH B2 ADRENERGIC AGONISTS ADRB2, CHRM2, NR3C2 NR3C1 10/4885PGR 443/4885MEN1 1963/4885
US-20090163456-A1 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS IN COMBINATION WITH B2 ADRENERGIC AGONISTS ADRB2, CHRM2, NR3C2 NR3C1 10/4885PGR 443/4885MEN1 1963/4885
US-20050009798-A1 Carbonate and carbamate modified forms of glucocorticoids in combination with B2 adrenergic agonists ADRB2, ADRA2C, NR3C2 NR3C1 12/4885PGR 449/4885MEN1 1765/4885

“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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