SCHEMBL6744304

SCHEMBL6744304

N=C(N)N/N=C\c1cc(/C=N/NC(=N)N)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
GAA P10253 3/20 0.50
KMT2A Q03164 3/20 0.50
POLB P06746 3/20 0.49
NOX4 Q9NPH5 1/20 0.49
MEN1 O00255 1/20 0.49
ALPL P05186 1/20 0.49
ALPI P09923 1/20 0.49
ALPG P10696 1/20 0.49
BLM P54132 1/20 0.49
ATM Q13315 1/20 0.49
TAAR1 Q96RJ0 1/20 0.49
SAE1 Q9UBE0 1/20 0.49
UBA2 Q9UBT2 1/20 0.49
MMP9 P14780 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.44
GFER P55789 1/20 0.42
MAPT P10636 1/20 0.41
NTRK1 P04629 1/20 0.41
LMNA P02545 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
SCHEMBL6744311 1.00 KDM4E (0.50) KDM4EGAAKMT2APOLBNOX4
SCHEMBL17044490 0.87 POLB (0.65) KDM4EGAAKMT2APOLBNOX4
SCHEMBL17044488 0.87 POLB (0.65) KDM4EGAAKMT2APOLBNOX4
Hydrochloric Acid SCHEMBL5703116 0.85 GAA (0.63) KDM4EGAAKMT2APOLBNOX4
SCHEMBL6743215 0.85 KMT2A (0.51) KDM4EGAAKMT2APOLBMEN1
Hydrochloric Acid SCHEMBL5703113 0.85 GAA (0.63) KDM4EGAAKMT2APOLBNOX4
SCHEMBL6743212 0.85 KMT2A (0.51) KDM4EGAAKMT2APOLBMEN1
SCHEMBL6573483 0.84 KDM4E (0.50) KDM4EGAAKMT2APOLBMEN1
SCHEMBL16993680 0.83 POLB (0.47) KDM4EGAAKMT2APOLBNOX4
SCHEMBL1520583 0.83 POLB (0.47) KDM4EGAAKMT2APOLBNOX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030186993-A1 Anti-malarial compounds, compositions and methods KENNETH S. WARREN INSTITUTE 2003-10-02 US claimed
US-6689777-B2 DEPOLYMERIZING HEMOZOIN USING 2-IMINO-NAPHTHO(1,2-D)THIAZOL-5-OL DERIVATIVES KENNETH S. WARREN INSTITUTE 2004-02-10 US disclosed
US-20030186993-A1 Anti-malarial compounds, compositions and methods KENNETH S. WARREN INSTITUTE 2003-10-02 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-20030186993-A1 Anti-malarial compounds, compositions and methods TYR, CRYZ, RHOT2 KDM4E 1240/4885GAA 260/4885KMT2A 2497/4885

“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.