SCHEMBL2236563

SCHEMBL2236563

Cc1nc(N(C)C)nc(C)c1OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.49
HTT P42858 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
STAT3 P40763 1/20 0.45
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TSHR P16473 1/20 0.43
POLB P06746 1/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
ATP4A P20648 3/20 0.41
ATP4B P51164 3/20 0.41
TLR9 Q9NR96 2/20 0.40
TLR7 Q9NYK1 2/20 0.40
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
ALOX5 P09917 1/20 0.39

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
SCHEMBL15306026 0.86 TSHR (0.41) L3MBTL1HTTSMN1; SMN2STAT3MAPT
SCHEMBL2238440 0.83 BCHE (0.41) L3MBTL1HTTSMN1; SMN2STAT3TSHR
SCHEMBL2234769 0.82 BCHE (0.43) L3MBTL1HTTSMN1; SMN2STAT3TSHR
SCHEMBL2236510 0.82 BCHE (0.43) L3MBTL1HTTSMN1; SMN2STAT3TSHR
SCHEMBL2234253 0.81 LTA4H (0.39) L3MBTL1HTTSMN1; SMN2STAT3TSHR
SCHEMBL2236849 0.80 L3MBTL1 (0.43) L3MBTL1HTTSMN1; SMN2STAT3TDP1
SCHEMBL10371116 0.80 HTT (0.56) L3MBTL1HTTSMN1; SMN2STAT3MAPT
SCHEMBL2234851 0.79 L3MBTL1 (0.56) L3MBTL1HTTSMN1; SMN2STAT3MAPT
SCHEMBL3619417 0.78 L3MBTL1 (0.50) L3MBTL1HTTSMN1; SMN2STAT3MAPT
SCHEMBL24583377 0.74 TSHR (0.47) L3MBTL1HTTSMN1; SMN2STAT3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2536690-B1 MULTIFUNCTIONAL RADICAL QUENCHERS AND THEIR USE UNIV ARIZONA (US) 2018-08-08 EP disclosed
EP-2536690-B1 MULTIFUNCTIONAL RADICAL QUENCHERS AND THEIR USE UNIV ARIZONA (US) 2018-08-08 EP disclosed
US-8952025-B2 Multifunctional radical quenchers and their uses ARIZONA BOARD OF REGENTS, A BODY CORPORATE OF THE STATE OF ARIZONA ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2015-02-10 US disclosed
US-8952025-B2 Multifunctional radical quenchers and their uses ARIZONA BOARD OF REGENTS, A BODY CORPORATE OF THE STATE OF ARIZONA ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2015-02-10 US disclosed
US-20130267546-A1 Multifunctional Radical Quenchers and Their Uses Arizona Board of Regents, a body corporate of the State of Arizona acting for and on behalf of Ari (US) 2013-10-10 US disclosed
US-20130267546-A1 Multifunctional Radical Quenchers and Their Uses Arizona Board of Regents, a body corporate of the State of Arizona acting for and on behalf of Ari (US) 2013-10-10 US disclosed
EP-2536690-A1 MULTIFUNCTIONAL RADICAL QUENCHERS AND THEIR USE Arizona Board Of Regents (US) 2012-12-26 EP disclosed
WO-2011103536-A1 MULTIFUNCTIONAL RADICAL QUENCHERS AND THEIR USE ARIZONA BOARD OF REGENTS (US) 2011-08-25 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-20130267546-A1 Multifunctional Radical Quenchers and Their Uses SQOR, GSR, GPX4 L3MBTL1 2443/4885HTT 1096/4885SMN1; SMN2 1226/4885

“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.