SCHEMBL13945461

SCHEMBL13945461

O=C(O)c1cccc(Nc2nc(-c3ccccc3)nc3ccccc23)c1

nearest known ligand 0.97

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.97
KMT2A Q03164 7/20 0.97
ABCG2 Q9UNQ0 12/20 0.86
L3MBTL1 Q9Y468 1/20 0.79
PDE5A O76074 3/20 0.78
ABCC1 P33527 1/20 0.74
MAPT P10636 4/20 0.72
TP53 P04637 2/20 0.72
SMN1; SMN2 Q16637 2/20 0.72
SIRT5 Q9NXA8 1/20 0.72
KDM4E B2RXH2 1/20 0.72
MAPK1 P28482 1/20 0.72
ABCB1 P08183 3/20 0.68

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
SCHEMBL7280956 0.93 ABCG2 (1.00) MEN1KMT2AABCG2L3MBTL1PDE5A
SCHEMBL13945465 0.92 MEN1 (0.82) MEN1KMT2AABCG2L3MBTL1PDE5A
SCHEMBL5526966 0.92 MEN1 (0.82) MEN1KMT2AABCG2L3MBTL1PDE5A
SCHEMBL1083771 0.90 MEN1 (0.98) MEN1KMT2AABCG2L3MBTL1PDE5A
SCHEMBL13945468 0.85 ABCG2 (1.00) MEN1KMT2AABCG2PDE5AABCC1
SCHEMBL3890403 0.84 MAPT (0.83) MEN1KMT2AABCG2L3MBTL1PDE5A
SCHEMBL1058652 0.84 ABCG2 (1.00) MEN1KMT2AABCG2PDE5AMAPT
SCHEMBL22201624 0.83 ABCG2 (0.83) MEN1KMT2AABCG2L3MBTL1PDE5A
SCHEMBL1063103 0.83 ABCG2 (1.00) MEN1KMT2AABCG2PDE5AABCC1
SCHEMBL5532972 0.81 MAPT (0.69) MEN1KMT2AABCG2L3MBTL1PDE5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090023773-A1 COMPOSITIONS AND METHODS FOR MODULATING GATED ION CHANNELS PAINCEPTOR PHARMA CORPORATION (CA) 2009-01-22 US disclosed
US-20090023773-A1 COMPOSITIONS AND METHODS FOR MODULATING GATED ION CHANNELS PAINCEPTOR PHARMA CORPORATION (CA) 2009-01-22 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-20090023773-A1 COMPOSITIONS AND METHODS FOR MODULATING GATED ION CHANNELS TRPV1, TRPV2, TRPA1 MEN1 4478/4885KMT2A 3931/4885ABCG2 602/4885

“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.