SCHEMBL589135

SCHEMBL589135

O=C(O)c1nc(Br)c(C(=O)O)nc1Br

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
MAPT P10636 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TDP1 Q9NUW8 3/20 0.34
PLAU P00749 2/20 0.34
LDHA P00338 1/20 0.33
LDHB P07195 1/20 0.33
KDM4E B2RXH2 4/20 0.32
ALOX15 P16050 3/20 0.32
TSHR P16473 3/20 0.32
ACMSD Q8TDX5 1/20 0.32
HCAR2 Q8TDS4 3/20 0.31
CYP3A4 P08684 1/20 0.31
BLM P54132 1/20 0.31
AGER Q15109 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
POLB P06746 1/20 0.31
HIF1A Q16665 1/20 0.31
COPS5 Q92905 1/20 0.31

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
SCHEMBL17628560 0.85 PLAU (0.44) ALDH1A1MAPTSMN1; SMN2TDP1PLAU
SCHEMBL12314678 0.76 PLAU (0.33) ALDH1A1MAPTSMN1; SMN2PLAUHCAR2
SCHEMBL9319709 0.75 ALDH1A1 (0.42) ALDH1A1MAPTSMN1; SMN2TDP1KDM4E
SCHEMBL14891402 0.75 PLAU (0.58) ALDH1A1MAPTSMN1; SMN2TDP1PLAU
SCHEMBL275483 0.73 ATR (0.44) ALDH1A1MAPTSMN1; SMN2TDP1KDM4E
SCHEMBL30588535 0.73 ATR (0.44) ALDH1A1MAPTSMN1; SMN2TDP1KDM4E
SCHEMBL22382 0.72 ALDH1A1 (0.55) ALDH1A1MAPTSMN1; SMN2TDP1LDHA
SCHEMBL20540894 0.71 TTR (0.39) ALDH1A1MAPTSMN1; SMN2TDP1KDM4E
SCHEMBL25285259 0.70 RXFP1 (0.31)
SCHEMBL2343868 0.70 TDP1 (0.37) TDP1PLAUKDM4EHCAR2COPS5

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 75 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3700578-B1 SYSTEMS FOR RENAL FUNCTION DETERMINATION MEDIBEACON INC (US) 2025-12-03 EP disclosed
US-12303570-B2 Compositions and methods for assessing eye vasculature MEDIBEACON INC. (US) 2025-05-20 US disclosed
US-20230173111-A1 COMPOSITIONS AND SYSTEMS FOR RENAL FUNCTION DETERMINATION MEDIBEACON INC. 2023-06-08 US disclosed
US-20230173111-A1 COMPOSITIONS AND SYSTEMS FOR RENAL FUNCTION DETERMINATION MEDIBEACON INC. 2023-06-08 US disclosed
US-20230173111-A1 COMPOSITIONS AND SYSTEMS FOR RENAL FUNCTION DETERMINATION MEDIBEACON INC. 2023-06-08 US disclosed
US-20230158175-A1 METHODS FOR RENAL FUNCTION DETERMINATION MEDIBEACON INC. 2023-05-25 US disclosed
US-20230158175-A1 METHODS FOR RENAL FUNCTION DETERMINATION MEDIBEACON INC. 2023-05-25 US disclosed
US-20230158175-A1 METHODS FOR RENAL FUNCTION DETERMINATION MEDIBEACON INC. 2023-05-25 US disclosed
US-20230132384-A9 COMPOSITIONS AND METHODS FOR ASSESSING EYE VASCULATURE MEDIBEACON INC. 2023-04-27 US disclosed
US-20230132384-A9 COMPOSITIONS AND METHODS FOR ASSESSING EYE VASCULATURE MEDIBEACON INC. 2023-04-27 US disclosed
US-8115000-B2 Pyrazine derivatives and uses thereof in renal monitoring MALLINCKRODT LLC (US) 2012-02-14 US disclosed
US-20100233091-A1 Pyrazine Derivatives with Extended Conjugation and Methods of Using the same in Optical Applications MEDIBEACON, INC. 2010-09-16 US disclosed
US-20090198053-A1 Pyrazine Derivatives and Uses Thereof in Renal Monitoring MEDIBEACON INC. 2009-08-06 US disclosed
US-20090198053-A1 Pyrazine Derivatives and Uses Thereof in Renal Monitoring MEDIBEACON INC. 2009-08-06 US disclosed
US-20090198053-A1 Pyrazine Derivatives and Uses Thereof in Renal Monitoring MEDIBEACON INC. 2009-08-06 US disclosed
EP-2038261-A2 PYRAZINE DERIVATIVES WITH EXTENDED CONJUGATION AND USES THEREOF Mallinckrodt Inc. (US) 2009-03-25 EP disclosed
EP-2029554-A1 PYRAZINE DERIVATIVES AND USES THEREOF IN RENAL MONITORING Mallinckrodt, Inc. (US) 2009-03-04 EP disclosed
WO-2007149478-A2 PYRAZINE DERIVATIVES WITH EXTENDED CONJUGATION AND USES THEREOF MALLINCKRODT INC. (US) 2007-12-27 WO disclosed
WO-2007149479-A1 PYRAZINE DERIVATIVES AND USES THEREOF IN RENAL MONITORING MALLINCKRODT INC. (US) 2007-12-27 WO disclosed
WO-2007149479-A1 PYRAZINE DERIVATIVES AND USES THEREOF IN RENAL MONITORING MALLINCKRODT INC. (US) 2007-12-27 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 (6 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-20230132384-A9 COMPOSITIONS AND METHODS FOR ASSESSING EYE VASCULATURE LIPG, FLT4, FABP3 ALDH1A1 1933/4885MAPT 2840/4885SMN1; SMN2 4165/4885
US-20230173111-A1 COMPOSITIONS AND SYSTEMS FOR RENAL FUNCTION DETERMINATION GLS, ATP6V1B1, REN ALDH1A1 3528/4885MAPT 4536/4885SMN1; SMN2 3946/4885
US-20090198053-A1 Pyrazine Derivatives and Uses Thereof in Renal Monitoring GLS, CYP3A5, PYCR1 ALDH1A1 268/4885MAPT 4132/4885SMN1; SMN2 3945/4885
US-20230158175-A1 METHODS FOR RENAL FUNCTION DETERMINATION GLS, SHBG, OGFR ALDH1A1 1776/4885MAPT 3918/4885SMN1; SMN2 2715/4885
US-20100233091-A1 Pyrazine Derivatives with Extended Conjugation and Methods of Using the same in Optical Applications CYP3A5, PAICS, CYP3A43 ALDH1A1 320/4885MAPT 468/4885SMN1; SMN2 3290/4885
US-12303570-B2 Compositions and methods for assessing eye vasculature LIPG, FLT4, FABP3 ALDH1A1 1933/4885MAPT 2840/4885SMN1; SMN2 4165/4885

“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.