SCHEMBL20187574

SCHEMBL20187574

Cn1nc(I)c2nc[nH]c(=O)c21

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.42
DAPK3 O43293 2/20 0.42
PRKD3 O94806 2/20 0.42
PIM1 P11309 2/20 0.42
PDGFRA P16234 2/20 0.42
PRKACA P17612 2/20 0.42
CSNK1A1 P48729 2/20 0.42
GSK3A P49840 2/20 0.42
GSK3B P49841 2/20 0.42
CDK5 Q00535 2/20 0.42
MAP2K1 Q02750 2/20 0.42
PRKCQ Q04759 2/20 0.42
DYRK1A Q13627 2/20 0.42
CLK4 Q9HAZ1 2/20 0.42
DYRK1B Q9Y463 2/20 0.42
CDK8 P49336 1/20 0.42
PIM3 Q86V86 1/20 0.42
ALDH1A1 P00352 3/20 0.40
KDM4A O75164 2/20 0.38
KDM4B O94953 2/20 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
SCHEMBL460818 0.81 DAPK3 (0.54) BRD4DAPK3PRKD3PIM1PDGFRA
SCHEMBL17164025 0.79 BRD4 (0.42) BRD4DAPK3PRKD3PIM1PDGFRA
SCHEMBL4903819 0.77 HPGD (0.47) BRD4DAPK3PRKD3PIM1PDGFRA
SCHEMBL31132800 0.76 BRD4 (0.40) BRD4DAPK3PRKD3PIM1PDGFRA
SCHEMBL20187962 0.76 HTT (0.43) BRD4DAPK3PRKD3PIM1PDGFRA
SCHEMBL1149887 0.74 PDE5A (0.52) BRD4DAPK3PRKD3PIM1PDGFRA
SCHEMBL31133071 0.72 HPGD (0.40) BRD4DAPK3PRKD3PIM1PDGFRA
SCHEMBL20196460 0.70 BRD4 (0.33) BRD4
SCHEMBL19917188 0.68 KDM5B (0.40) BRD4DAPK3PRKD3PIM1PDGFRA
SCHEMBL21273002 0.67 PIM1 (0.43) BRD4DAPK3PRKD3PIM1PDGFRA

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110225911-B Oxadiazolone transient receptor potential channel inhibitors 豪夫迈·罗氏有限公司 2022-04-05 CN disclosed
EP-3526239-B1 HIF 1-ALPHA ANTISENSE OLIGONUCLEOTIDES OLIPASS CORP (KR) 2021-11-03 EP disclosed
EP-3544979-B1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS HOFFMANN LA ROCHE (CH) 2021-08-04 EP disclosed
EP-3544979-B1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS HOFFMANN LA ROCHE (CH) 2021-08-04 EP disclosed
US-10913742-B2 Oxadiazolones as transient receptor potential channel inhibitors GENENTECH, INC. (US) 2021-02-09 US disclosed
US-10913742-B2 Oxadiazolones as transient receptor potential channel inhibitors GENENTECH, INC. (US) 2021-02-09 US disclosed
EP-3544979-A1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS H. Hoffnabb-La Roche Ag (CH) 2019-10-02 EP disclosed
US-20190284189-A1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2019-09-19 US disclosed
US-20190284189-A1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2019-09-19 US disclosed
WO-2018096159-A1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2018-05-31 WO disclosed
WO-2018096159-A1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2018-05-31 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 (2 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-10913742-B2 Oxadiazolones as transient receptor potential channel inhibitors TRPA1, TRPV1, TRPV3 BRD4 3292/4885DAPK3 757/4885PRKD3 2897/4885
US-20190284189-A1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS TRPA1, TRPV1, TRPV3 BRD4 3292/4885DAPK3 757/4885PRKD3 2897/4885

“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.