SCHEMBL26310096

SCHEMBL26310096

O=C(Nc1cccc(Nc2ccncc2)n1)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.69
POLB P06746 4/20 0.69
MITF O75030 2/20 0.69
MAPK1 P28482 1/20 0.69
KMT2A Q03164 7/20 0.58
MEN1 O00255 5/20 0.58
CYP11B1 P15538 1/20 0.55
CYP11B2 P19099 1/20 0.55
ALDH1A1 P00352 2/20 0.51
LMNA P02545 2/20 0.51
KDR P35968 1/20 0.51
USP2 O75604 1/20 0.50
CTDSP1 Q9GZU7 1/20 0.50
NPC1 O15118 4/20 0.49
KDM4E B2RXH2 1/20 0.49
RAB9A P51151 3/20 0.49
RXFP1 Q9HBX9 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.47
STAT1 P42224 1/20 0.47

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
SCHEMBL24004065 0.86 POLB (0.58) MAPTPOLBMITFMAPK1KMT2A
SCHEMBL16899268 0.83 KMT2A (0.72) POLBMITFKMT2AMEN1LMNA
SCHEMBL24004063 0.82 POLB (0.66) MAPTPOLBMITFMAPK1KMT2A
SCHEMBL1886207 0.82 MAPT (1.00) MAPTPOLBMITFMAPK1KMT2A
SCHEMBL12218027 0.82 MAPT (1.00) MAPTPOLBMITFMAPK1KMT2A
SCHEMBL25822055 0.81 MAPT (0.74) MAPTPOLBMITFMAPK1KMT2A
SCHEMBL12639160 0.81 MAPT (0.79) MAPTPOLBMITFMAPK1KMT2A
SCHEMBL26310094 0.78 KMT2A (0.60) MAPTPOLBMITFKMT2AMEN1
SCHEMBL16899271 0.78 KMT2A (0.60) MAPTPOLBKMT2AMEN1ALDH1A1
SCHEMBL30290863 0.77 KMT2A (0.54) KMT2AMEN1NPC1KDM4ERAB9A

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-20230295114-A1 AKT3 MODULATORS Georgiamune Inc. 2023-09-21 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-20230295114-A1 AKT3 MODULATORS AKT3, AKT2, MTOR MAPT 3962/4885POLB 2552/4885MITF 1450/4885

“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.