SCHEMBL4382528

SCHEMBL4382528

COc1ncccc1CON

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 13/20 0.52
KDM1A O60341 3/20 0.43
SLC13A5 Q86YT5 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
APLNR P35414 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
AGXT P21549 1/20 0.41

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
SCHEMBL8220219 0.82 SLC13A5 (0.48) IDO1KDM1ASLC13A5MAOAMAOB
SCHEMBL29587038 0.81 KDM1A (0.46) KDM1ASLC13A5MAOAMAOBAPLNR
SCHEMBL1265988 0.81 KDM1A (0.46) KDM1ASLC13A5MAOAMAOBAPLNR
Hydrochloric Acid SCHEMBL5900832 0.79 KDM1A (0.44) KDM1ASLC13A5MAOAMAOBAPLNR
Hydrochloric Acid SCHEMBL16797857 0.79 KDM1A (0.44) KDM1ASLC13A5MAOAMAOBAPLNR
SCHEMBL91503 0.79 SLC13A5 (0.50) KDM1ASLC13A5MAOAMAOBAPLNR
SCHEMBL28960253 0.78 SLC13A5 (0.48) KDM1ASLC13A5MAOAMAOB
SCHEMBL3055288 0.78 TAAR1 (0.52) KDM1ASLC13A5MAOAMAOBAPLNR
SCHEMBL13359015 0.77 HPGD (0.44) KDM1ASLC13A5MAOAMAOBAPLNR
SCHEMBL6588356 0.77 SLC13A5 (0.49) KDM1ASLC13A5MAOAMAOBAPLNR

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 305/4885KDM1A 1271/4885SLC13A5 848/4885

“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.