SCHEMBL2690754

SCHEMBL2690754

NC(N)=NC(=O)c1nc(Cl)c(Cl)nc1N

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 11/20 0.83
CYP1A2 P05177 6/20 0.83
SLC9A1 P19634 6/20 0.83
TSHR P16473 5/20 0.83
SLC9A5 Q14940 5/20 0.83
ALDH1A1 P00352 4/20 0.83
CYP2D6 P10635 4/20 0.83
KDM4E B2RXH2 3/20 0.83
GLA P06280 3/20 0.83
HPGD P15428 3/20 0.83
HSD17B10 Q99714 3/20 0.83
LMNA P02545 3/20 0.83
CYP2C19 P33261 3/20 0.83
GAA P10253 2/20 0.83
FTO Q9C0B1 2/20 0.83
ADORA2A P29274 2/20 0.83
OPRM1 P35372 2/20 0.83
BLM P54132 2/20 0.83
SLC22A1 O15245 1/20 0.83
HTR1A P08908 1/20 0.83

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
Amiloride SCHEMBL27563 0.91 PLAU (1.00) PLAUCYP1A2SLC9A1TSHRSLC9A5
Amiloride SCHEMBL29531132 0.91 PLAU (1.00) PLAUCYP1A2SLC9A1TSHRSLC9A5
Amiloride SCHEMBL4155066 0.89 ALDH1A1 (1.00) PLAUCYP1A2SLC9A1TSHRSLC9A5
Amiloride SCHEMBL136682 0.87 PLAU (0.93) PLAUCYP1A2SLC9A1TSHRSLC9A5
Amiloride SCHEMBL871514 0.86 PLAU (0.90) PLAUCYP1A2SLC9A1TSHRSLC9A5
SCHEMBL10087514 0.86 PLAU (0.73) PLAUCYP1A2SLC9A1TSHRSLC9A5
SCHEMBL20819986 0.85 PLAU (0.66) PLAUCYP1A2SLC9A1TSHRSLC9A5
SCHEMBL9852481 0.82 CYP1A2 (1.00) PLAUCYP1A2SLC9A1TSHRSLC9A5
SCHEMBL15290919 0.82 PLAU (0.67) PLAUCYP1A2SLC9A1TSHRSLC9A5
SCHEMBL29406659 0.82 CYP1A2 (1.00) PLAUCYP1A2SLC9A1TSHRSLC9A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546322-B2 Inhibitors of intracellular urokinase plasminogen activator and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-10-01 US disclosed
US-8546322-B2 Inhibitors of intracellular urokinase plasminogen activator and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-10-01 US disclosed
US-8546322-B2 Inhibitors of intracellular urokinase plasminogen activator and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-10-01 US disclosed
US-20120108494-A1 INHIBITORS OF INTRACELLULAR UROKINASE PLASMINOGEN ACTIVATOR AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-05-03 US disclosed
US-20120108494-A1 INHIBITORS OF INTRACELLULAR UROKINASE PLASMINOGEN ACTIVATOR AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-05-03 US disclosed
US-20120108494-A1 INHIBITORS OF INTRACELLULAR UROKINASE PLASMINOGEN ACTIVATOR AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-05-03 US disclosed
EP-2185153-A2 INHIBITORS OF INTRACELLULAR UROKINASE PLASMINOGEN ACTIVATOR AND METHODS OF USE THEREOF The Regents of the University of California (US) 2010-05-19 EP disclosed
WO-2009020877-A2 INHIBITORS OF INTRACELLULAR UROKINASE PLASMINOGEN ACTIVATOR AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-02-12 WO disclosed
EP-0451130-A2 Use of amiloride and other pyrazine derivatives for preventing or treating ocular neovascularization CELTRIX PHARMACEUTICALS, INC. (US) 1991-10-09 EP disclosed
US-4604394-A Antiarrhythmic compositions and method MERCK & CO., INC. (US) 1986-08-05 US 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-20120108494-A1 INHIBITORS OF INTRACELLULAR UROKINASE PLASMINOGEN ACTIVATOR AND METHODS OF USE THEREOF PLAU, PLAUR, DNPEP PLAU 1/4885CYP1A2 4875/4885SLC9A1 370/4885

“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.