SCHEMBL18655362

SCHEMBL18655362

CNc1c2cc([N+](=O)[O-])ccc2nc2c1ccc1ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.49
MEN1 O00255 4/20 0.49
MAPT P10636 3/20 0.45
ACHE P22303 2/20 0.45
MAOA P21397 1/20 0.44
KDM4E B2RXH2 2/20 0.43
GLA P06280 2/20 0.43
ALDH1A1 P00352 2/20 0.43
POLB P06746 2/20 0.43
OPRK1 P41145 1/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ABCG2 Q9UNQ0 1/20 0.43
NPC1 O15118 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL18655359 0.91 ACHE (0.45) KMT2AMEN1MAPTACHEKDM4E
SCHEMBL18631802 0.87 ACHE (0.44) KMT2AMEN1MAPTACHEMAOA
SCHEMBL18631835 0.81 KMT2A (0.52) KMT2AMEN1MAPTACHEMAOA
SCHEMBL18655365 0.78 MAOA (0.50) KMT2AMAPTMAOAKDM4EPOLB
SCHEMBL18631799 0.78 ACHE (0.44) KMT2AMEN1MAPTACHEKDM4E
SCHEMBL18655357 0.78 MAOA (0.49) KMT2AMEN1MAPTACHEMAOA
SCHEMBL18650744 0.77 TERT (0.44) KMT2AMEN1MAPTACHEMAOA
SCHEMBL18631825 0.77 KMT2A (0.48) KMT2AMEN1MAPTMAOAKDM4E
SCHEMBL18650739 0.75 L3MBTL1 (0.47) MAPTMAOAALDH1A1MAPK1TDP1
SCHEMBL18631804 0.74 KMT2A (0.47) KMT2AMEN1MAPTACHEALDH1A1

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-20170081351-A1 Design, Synthesis, and Biological Activity of Platinum-benz[c]acridine Hybrid Agents and Methods Associated Therewith WAKE FOREST UNIVERSITY 2017-03-23 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-20170081351-A1 Design, Synthesis, and Biological Activity of Platinum-benz[c]acridine Hybrid Agents and Methods Associated Therewith ACR, TP53, MCL1 KMT2A 3861/4885MEN1 1372/4885MAPT 4258/4885

“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.