SCHEMBL13204583

SCHEMBL13204583

c1cc2cc(-c3ccc4cc(-c5ccc6oc(C7=NCCN7)cc6c5)[nH]c4c3)[nH]c2cc1C1=NCCN1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 5/20 1.00
▸ PRMT3 O60678 1/20 1.00
▸ EHMT2 Q96KQ7 1/20 1.00
▸ PRMT6 Q96LA8 1/20 1.00
▸ PRMT8 Q9NR22 1/20 1.00
▸ NISCH Q9Y2I1 3/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ CYP1A2 P05177 2/20 0.53
▸ CYP2D6 P10635 2/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ ADRA2A P08913 1/20 0.53
▸ HPGD P15428 1/20 0.53
▸ ADRA2B P18089 1/20 0.53
▸ ADRA2C P18825 1/20 0.53
▸ MAOA P21397 1/20 0.53
▸ MAOB P27338 1/20 0.53
▸ USP2 O75604 1/20 0.51
▸ POLB P06746 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51

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
SCHEMBL14854516 0.93 PRMT1 (0.88) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL14854546 0.85 PRMT1 (0.74) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL14854501 0.85 PRMT1 (0.74) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL14535010 0.83 PRMT1 (0.70) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL8238119 0.83 PRMT1 (0.69) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL14854553 0.82 PRMT1 (0.69) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL362453 0.81 PRMT1 (0.68) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL8229714 0.81 PRMT1 (0.71) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL14817020 0.80 PRMT1 (0.67) PRMT1PRMT3EHMT2PRMT6PRMT8
Hydrochloric Acid SCHEMBL3383477 0.80 PRMT1 (0.66) PRMT1PRMT3EHMT2PRMT6PRMT8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1945209-B1 BROAD SPECTRUM ANTIBACTERIAL COMPOUNDS US GOV AS REPRESENTED BY THE SECRETARY OF THE UNITED STATES ARMY AND THE U S ARMY MEDICAL RESEARCH (US) 2018-05-30 — — EP disclosed
EP-1945209-B1 BROAD SPECTRUM ANTIBACTERIAL COMPOUNDS US GOV AS REPRESENTED BY THE SECRETARY OF THE UNITED STATES ARMY AND THE U S ARMY MEDICAL RESEARCH (US) 2018-05-30 — — EP disclosed
US-7781183-B2 Inhibition of anthrax lethal factor protease THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 2010-08-24 — — US disclosed
US-7781183-B2 Inhibition of anthrax lethal factor protease THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 2010-08-24 — — US disclosed
US-20070112048-A1 Broad Spectrum Antibacterial Compounds U.S. ARMY MEDICAL RESEARCH AND MATERIEL COMMAND 2007-05-17 — — 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-20070112048-A1 Broad Spectrum Antibacterial Compounds MPO, CAT, LPO PRMT1 2817/4885PRMT3 2516/4885EHMT2 4689/4885

“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.

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