SCHEMBL2260163

SCHEMBL2260163

CN1CCN(c2ncnc(N3CCC(C(=O)NCc4ccccc4C(F)(F)F)CC3)n2)CC1

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 20/20 0.81
CYP2C9 P11712 14/20 0.81
CYP3A4 P08684 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
SCHEMBL2258419 0.94 EPHX2 (0.91) EPHX2CYP2C9CYP3A4
SCHEMBL2260328 0.91 EPHX2 (0.84) EPHX2CYP2C9CYP3A4
SCHEMBL2260145 0.90 EPHX2 (0.83) EPHX2CYP2C9CYP3A4
SCHEMBL2259128 0.90 EPHX2 (1.00) EPHX2CYP2C9CYP3A4
SCHEMBL2261596 0.90 EPHX2 (0.83) EPHX2CYP2C9CYP3A4
SCHEMBL2259396 0.89 EPHX2 (0.82) EPHX2CYP2C9CYP3A4
SCHEMBL2263070 0.89 EPHX2 (0.81) EPHX2CYP2C9
SCHEMBL2259931 0.88 EPHX2 (0.80) EPHX2CYP2C9CYP3A4
SCHEMBL2261413 0.88 EPHX2 (0.80) EPHX2CYP2C9CYP3A4
SCHEMBL2260321 0.88 EPHX2 (0.84) EPHX2CYP2C9CYP3A4

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 15 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 claimed
US-8008483-B2 sEH inhibitors and their use GlaxoSmithKline, LLC (US) 2011-08-30 US claimed
US-20100210628-A1 NOVEL sEH INHIBITORS AND THEIR USE GLAXOSMITHKLINE LLC 2010-08-19 US claimed
EP-2209376-A1 NOVEL SEH INHIBITORS AND THEIR USE GlaxoSmithKline LLC (US) 2010-07-28 EP claimed
WO-2009049165-A1 NOVEL SEH INHIBITORS AND THEIR USE SMITHKLINE BEECHAM CORPORATION (US) 2009-04-16 WO claimed
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-8008483-B2 sEH inhibitors and their use GlaxoSmithKline, LLC (US) 2011-08-30 US 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
US-20100210628-A1 NOVEL sEH INHIBITORS AND THEIR USE GLAXOSMITHKLINE LLC 2010-08-19 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
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 EPHX2 4/4885CYP2C9 160/4885CYP3A4 145/4885

“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.