SCHEMBL2265144

SCHEMBL2265144

CCOC(=O)C1CCN(c2nc(Cl)nc(NC)n2)CC1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.54
KMT2A Q03164 3/20 0.51
MAPT P10636 3/20 0.50
ALDH1A1 P00352 4/20 0.46
EPHX2 P34913 7/20 0.46
PTPN11 Q06124 1/20 0.45
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 2/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CYP2C9 P11712 2/20 0.42

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
SCHEMBL2264334 0.89 MAPT (0.57) MAPK1KMT2AMAPTALDH1A1PTPN11
SCHEMBL2260571 0.88 KMT2A (0.55) MAPK1KMT2AMAPTALDH1A1EPHX2
SCHEMBL2259603 0.82 KDM4E (0.54) MAPK1KMT2AMAPTALDH1A1EPHX2
SCHEMBL868893 0.82 ALDH1A1 (0.60) KMT2AMAPTALDH1A1PTPN11KDM4E
SCHEMBL10055318 0.79 ALDH1A1 (0.55) KMT2AMAPTALDH1A1PTPN11KDM4E
SCHEMBL10078816 0.77 KDM4E (0.60) KMT2AMAPTALDH1A1PTPN11KDM4E
SCHEMBL22807107 0.76 SMN1; SMN2 (0.55) KMT2AMAPTALDH1A1KDM4EMEN1
SCHEMBL25488825 0.76 MAPT (0.61) MAPK1KMT2AMAPTALDH1A1KDM4E
SCHEMBL3759702 0.74 MAPT (0.53) MAPK1KMT2AMAPTALDH1A1PTPN11
SCHEMBL20267596 0.74 PTPN11 (0.57) KMT2AMAPTALDH1A1PTPN11KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2209376-B1 NOVEL SEH INHIBITORS AND THEIR USE GLAXOSMITHKLINE LLC (US) 2013-03-06 EP disclosed
US-8008483-B2 sEH inhibitors and their use GlaxoSmithKline, LLC (US) 2011-08-30 US disclosed
US-20100210628-A1 NOVEL sEH INHIBITORS AND THEIR USE GLAXOSMITHKLINE LLC 2010-08-19 US disclosed
EP-2209376-A1 NOVEL SEH INHIBITORS AND THEIR USE GlaxoSmithKline LLC (US) 2010-07-28 EP disclosed
WO-2009049165-A1 NOVEL SEH INHIBITORS AND THEIR USE SMITHKLINE BEECHAM CORPORATION (US) 2009-04-16 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-20100210628-A1 NOVEL sEH INHIBITORS AND THEIR USE EPHX1, NCEH1, CYP46A1 MAPK1 1590/4885KMT2A 938/4885MAPT 3384/4885

“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.