SCHEMBL2265219

SCHEMBL2265219

Cc1nc(Cl)nc(N2CCC(C(=O)NCc3ccc(Cl)cc3Cl)CC2)n1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 15/20 0.57
GAA P10253 1/20 0.57
HTT P42858 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
KDM4E B2RXH2 1/20 0.52
LMNA P02545 1/20 0.52
MAPK1 P28482 1/20 0.52
P2RX7 Q99572 1/20 0.52

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
SCHEMBL2259410 0.86 EPHX2 (0.56) EPHX2GAAHTTSMN1; SMN2LMNA
SCHEMBL2786343 0.84 EPHX2 (0.57) EPHX2GAAHTTSMN1; SMN2KDM4E
SCHEMBL3475524 0.83 EPHX2 (0.66) EPHX2GAAHTTSMN1; SMN2KDM4E
SCHEMBL13876177 0.82 EPHX2 (0.61) EPHX2GAAHTTKDM4EP2RX7
SCHEMBL2786704 0.82 EPHX2 (0.66) EPHX2GAAHTTP2RX7
SCHEMBL2261513 0.81 EPHX2 (0.66) EPHX2GAAHTTSMN1; SMN2
SCHEMBL2258231 0.80 EPHX2 (0.80) EPHX2
SCHEMBL3473829 0.78 SMN1; SMN2 (0.69) EPHX2GAAHTTSMN1; SMN2KDM4E
SCHEMBL2787853 0.78 EPHX2 (0.67) EPHX2GAAHTTSMN1; SMN2P2RX7
SCHEMBL3475200 0.78 P2RX7 (0.49) EPHX2GAAHTTSMN1; SMN2KDM4E

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
EP-2209376-B1 NOVEL SEH INHIBITORS AND THEIR USE GLAXOSMITHKLINE LLC (US) 2013-03-06 EP disclosed
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
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 4/4885GAA 487/4885HTT 3222/4885

“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.