SCHEMBL25825376

SCHEMBL25825376

O=C(Nc1ccc(Nc2ccccc2)cc1)c1ccc(Nc2ccnc3ccc([N+](=O)[O-])cc23)cn1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.68
MAPT P10636 5/20 0.68
USP2 O75604 2/20 0.68
MAPK1 P28482 2/20 0.63
ALDH1A1 P00352 2/20 0.63
POLB P06746 2/20 0.63
KDM4E B2RXH2 1/20 0.63
THRB P10828 1/20 0.63
MCL1 Q07820 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
MEN1 O00255 3/20 0.52
DNMT1 P26358 4/20 0.50
DNMT3A Q9Y6K1 3/20 0.50
CCNC P24863 1/20 0.49
CDK8 P49336 1/20 0.49
DNMT3L Q9UJW3 1/20 0.49
EGFR P00533 1/20 0.48
KDR P35968 2/20 0.48
GFER P55789 1/20 0.46
P4HTM Q9NXG6 1/20 0.46

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
SCHEMBL30180507 0.92 KMT2A (0.80) KMT2AMAPTUSP2MAPK1ALDH1A1
SCHEMBL19151510 0.92 KMT2A (0.80) KMT2AMAPTUSP2MAPK1ALDH1A1
SCHEMBL13335886 0.89 KMT2A (0.85) KMT2AMAPTUSP2MAPK1ALDH1A1
SCHEMBL13335888 0.86 KMT2A (0.74) KMT2AMAPTUSP2MAPK1ALDH1A1
SCHEMBL25825392 0.85 DNMT1 (0.54) KMT2AMAPTUSP2MAPK1ALDH1A1
SCHEMBL13335884 0.85 MAPT (0.77) KMT2AMAPTUSP2MAPK1ALDH1A1
SCHEMBL25825372 0.84 KMT2A (0.70) KMT2AMAPTUSP2MAPK1ALDH1A1
SCHEMBL25825387 0.84 DNMT1 (0.58) KMT2AMAPTUSP2MAPK1ALDH1A1
SCHEMBL25819890 0.83 KMT2A (0.68) KMT2AMAPTUSP2MAPK1ALDH1A1
SCHEMBL25825389 0.82 DNMT1 (0.56) KMT2AMAPTUSP2ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 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-20230183226-A1 AKT3 MODULATORS AKT3, AKT2, MTOR KMT2A 3974/4885MAPT 3999/4885USP2 3935/4885

“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.