SCHEMBL4385547

SCHEMBL4385547

CC(C)(C)OC(=O)N1c2ccccc2CC1CON

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.43
NOTUM Q6P988 1/20 0.43
BCHE P06276 1/20 0.41
KDM1A O60341 1/20 0.40
NAMPT P43490 1/20 0.40
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL4385549 1.00 ALOX5AP (0.43) ALOX5APNOTUMBCHEKDM1ANAMPT
SCHEMBL5332810 0.88 AKT1 (0.45) ALOX5APNOTUMBCHEKDM1ANAMPT
SCHEMBL30681234 0.88 AKT1 (0.45) ALOX5APNOTUMBCHEKDM1ANAMPT
SCHEMBL5332801 0.88 AKT1 (0.45) ALOX5APNOTUMBCHEKDM1ANAMPT
SCHEMBL30681300 0.88 AKT1 (0.45) ALOX5APNOTUMBCHEKDM1ANAMPT
SCHEMBL19056685 0.87 NOTUM (0.44) NOTUMBCHEKDM1ANAMPT
SCHEMBL31158605 0.87 NOTUM (0.44) NOTUMBCHEKDM1ANAMPT
SCHEMBL30681293 0.86 ALOX5AP (0.42) ALOX5APNOTUMBCHENAMPTALDH1A1
SCHEMBL6394797 0.85 ALOX5AP (0.41) ALOX5APNOTUMBCHEKDM1ANAMPT
SCHEMBL1760601 0.85 DRD2 (0.47) ALOX5APNOTUMBCHEKDM1ANAMPT

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 3 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
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 ALOX5AP 702/4885NOTUM 1979/4885BCHE 1798/4885

“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.