SCHEMBL4382906

SCHEMBL4382906

COc1cc(CON)cc(Cl)n1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 18/20 0.47
AGXT P21549 9/20 0.40
CYP3A4 P08684 2/20 0.38
LOX P28300 1/20 0.36
LOXL2 Q9Y4K0 1/20 0.36

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
SCHEMBL12988241 0.85 GRM5 (0.35) LOXLOXL2
SCHEMBL1715959 0.82 IDO1 (0.60) IDO1AGXTCYP3A4
SCHEMBL17169789 0.81 SMN1; SMN2 (0.38) LOXLOXL2
SCHEMBL12989688 0.81 SMN1; SMN2 (0.40) LOXLOXL2
Hydrochloric Acid SCHEMBL1715092 0.81 IDO1 (0.61) IDO1AGXTCYP3A4
Hydrochloric Acid SCHEMBL7451596 0.79 SMN1; SMN2 (0.38) LOXLOXL2
SCHEMBL13990856 0.79 SMN1; SMN2 (0.41) LOXLOXL2
SCHEMBL3219316 0.79 SMN1; SMN2 (0.36) LOXLOXL2
SCHEMBL3145992 0.79 GRM5 (0.30)
SCHEMBL2541070 0.78 RECQL (0.41) LOXLOXL2

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
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 US disclosed
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 US disclosed
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 US disclosed
EP-2040698-A2 OXIME COMPOUNDS AND THE USE THEREOF SHIONOGI & CO., LTD. (JP) 2009-04-01 EP disclosed
WO-2008008398-A2 OXIME COMPOUNDS AND THE USE THEREOF SHIONOGI & CO., LTD. (JP) 2008-01-17 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-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF KCNN4, CACNA1A, KCNN3 IDO1 305/4885AGXT 3147/4885CYP3A4 108/4885

“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.