SCHEMBL215303

SCHEMBL215303

CC(C)(C)OC(=O)N1CCN(CCCOc2ccc(N)c(Cl)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.52
HRH2 P25021 9/20 0.51
HRH1 P35367 9/20 0.51
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
DRD2 P14416 1/20 0.46
THRB P10828 1/20 0.46

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
SCHEMBL13320335 0.88 EPHX2 (0.52) EPHX2HRH2HRH1
SCHEMBL214957 0.85 EPHX2 (0.50) EPHX2HRH2HRH1
SCHEMBL216291 0.84 EPHX2 (0.52) EPHX2KDM4EALDH1A1DRD2
SCHEMBL18910879 0.84 EPHX2 (0.59) EPHX2HRH2HRH1DRD2
SCHEMBL2735430 0.84 KDM4E (0.53) EPHX2HRH2HRH1KDM4EALDH1A1
SCHEMBL3576150 0.83 KDM4E (0.56) EPHX2HRH2HRH1KDM4EALDH1A1
SCHEMBL215819 0.83 EPHX2 (0.59) EPHX2SMN1; SMN2
SCHEMBL216186 0.82 HTR4 (0.48) EPHX2HRH2HRH1KDM4EALDH1A1
SCHEMBL30983899 0.82 KDM4E (0.53) EPHX2HRH2HRH1KDM4EALDH1A1
SCHEMBL18910793 0.81 EPHX2 (0.48) EPHX2HRH2HRH1KDM4EALDH1A1

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-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 US disclosed
US-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 US disclosed
US-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 US disclosed
US-20100136136-A1 JAK-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2010-06-03 US disclosed
US-20100136136-A1 JAK-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2010-06-03 US disclosed
EP-2061768-A2 IMIDAZOLE-4,5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS Exelixis, Inc. (US) 2009-05-27 EP disclosed
WO-2008042282-A2 IMIDAZOLE-4, 5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS EXELIXIS, INC. (US) 2008-04-10 WO disclosed
WO-2008042282-A2 IMIDAZOLE-4, 5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS EXELIXIS, INC. (US) 2008-04-10 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 (1 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-20100136136-A1 JAK-2 Modulators and Methods of Use JAK2, JAK1, JAK3 EPHX2 2115/4885HRH2 884/4885HRH1 1368/4885

“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.