SCHEMBL2294822

SCHEMBL2294822

CC(C)(C)OC(=O)NC1Cn2c(=O)cnc3cccc1c32

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
PDE10A Q9Y233 3/20 0.38
GAA P10253 1/20 0.37
CKS1B P61024 1/20 0.36
SKP1 P63208 1/20 0.36
SKP2 Q13309 1/20 0.36
JAK1 P23458 6/20 0.36
JAK2 O60674 3/20 0.36
JAK3 P52333 2/20 0.36
TYK2 P29597 1/20 0.36
EPHX2 P34913 1/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
DGAT1 O75907 1/20 0.35
BTK Q06187 1/20 0.34
CTSK P43235 1/20 0.33

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
SCHEMBL2288479 1.00 HTR1A (0.41) HTR1AKDM4EALDH1A1PDE10AGAA
SCHEMBL1711984 0.83 JAK1 (0.38) PDE10AGAAJAK1JAK2JAK3
SCHEMBL1712022 0.83 JAK1 (0.38) PDE10AGAAJAK1JAK2JAK3
SCHEMBL1712214 0.82 HTR1A (0.41) HTR1AKDM4EALDH1A1CKS1BSKP1
SCHEMBL1723261 0.81 GAA (0.39) HTR1APDE10AGAACKS1BSKP1
SCHEMBL1723562 0.81 GAA (0.39) HTR1APDE10AGAACKS1BSKP1
SCHEMBL1712403 0.81 KCNH2 (0.36) HTR1AKDM4EALDH1A1PDE10AGAA
SCHEMBL1712577 0.77 KCNH2 (0.39) PDE10AGAAJAK1JAK2NFKB1
SCHEMBL1723518 0.75 GAA (0.36) GAAJAK1JAK2JAK3TYK2
SCHEMBL2288881 0.73 BRD4 (0.36) GAAJAK1JAK2JAK3TYK2

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 7 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

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 HTR1A 2667/4885KDM4E 3061/4885ALDH1A1 3208/4885
US-20160237088-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS H1-3, HRH3, HRH4 HTR1A 1898/4885KDM4E 2290/4885ALDH1A1 3572/4885
US-20140142093-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS OXA1L, H1-3, NGLY1 HTR1A 2208/4885KDM4E 2854/4885ALDH1A1 3751/4885

“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.