SCHEMBL1711984

SCHEMBL1711984

CC(C)(C)OC(=O)N[C@@H]1Cn2c(=O)ccc3nccc1c32

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 6/20 0.38
JAK2 O60674 3/20 0.38
GAA P10253 1/20 0.38
PDE10A Q9Y233 3/20 0.37
EPHX2 P34913 1/20 0.37
TYK2 P29597 1/20 0.37
JAK3 P52333 1/20 0.37
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
MAP4K4 O95819 2/20 0.36
KDM4D Q6B0I6 1/20 0.35
CTSK P43235 2/20 0.34
DGAT1 O75907 1/20 0.34

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
SCHEMBL1712022 1.00 JAK1 (0.38) JAK1JAK2GAAPDE10AEPHX2
SCHEMBL2288479 0.83 HTR1A (0.41) JAK1JAK2GAAPDE10AEPHX2
SCHEMBL2294822 0.83 HTR1A (0.41) JAK1JAK2GAAPDE10AEPHX2
SCHEMBL1712013 0.82 ACACB (0.39) JAK1JAK2
SCHEMBL1712152 0.82 ACACB (0.39) JAK1JAK2
SCHEMBL1723518 0.81 GAA (0.36) JAK1JAK2GAAEPHX2TYK2
SCHEMBL13315097 0.80 JAK1 (0.43) JAK1JAK2PDE10ATYK2JAK3
SCHEMBL1712577 0.80 KCNH2 (0.39) JAK1JAK2GAAPDE10ANFKB1
SCHEMBL1723562 0.80 GAA (0.39) JAK1JAK2GAAPDE10AEPHX2
SCHEMBL1723261 0.80 GAA (0.39) JAK1JAK2GAAPDE10AEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9822114-B2 Tricyclic oxazolidinone antibiotic compounds IDORSIA PHARMACEUTICALS LTD (CH) 2017-11-21 US disclosed
US-20160237088-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS IDORSIA PHARMACEUTICALS LTD (CH) 2016-08-18 US disclosed
US-9346804-B2 Tricyclic oxazolidinone antibiotic compounds ACTELION PHARMACEUTICALS LTD. (CH) 2016-05-24 US disclosed
EP-2344495-B1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2014-12-31 EP disclosed
US-20140142093-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS ACTELION PHARMACEUTICALS LTD. (CH) 2014-05-22 US disclosed
US-8618092-B2 Tricyclic oxazolidinone antibiotic compounds ACTELION PHARMACEUTICALS LTD. (CH) 2013-12-31 US disclosed
US-20110195961-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS ACTELION PHARMACEUTICALS LTD. (CH) 2011-08-11 US disclosed
EP-2344495-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS Actelion Pharmaceuticals Ltd. (CH) 2011-07-20 EP disclosed
WO-2010041194-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2010-04-15 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 (3 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-20110195961-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS HRH3, OXA1L, HRH1 JAK1 2707/4885JAK2 1378/4885GAA 4509/4885
US-20160237088-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS H1-3, HRH3, HRH4 JAK1 2849/4885JAK2 1401/4885GAA 4308/4885
US-20140142093-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS OXA1L, H1-3, NGLY1 JAK1 2736/4885JAK2 1505/4885GAA 4356/4885

“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.