SCHEMBL21633743

SCHEMBL21633743

O=P(=O)C1=CC2=CC3=NC(=CC4=NC(=CC5=NC(=CC1=N2)C=C5)C=C4)C=C3

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL1484247 0.72 — —
SCHEMBL352670 0.72 — —
SCHEMBL722604 0.71 — —
SCHEMBL587850 0.70 — —
SCHEMBL17459903 0.70 — —
SCHEMBL180000 0.70 — —
SCHEMBL466965 0.70 — —
Hydrochloric Acid SCHEMBL5165812 0.70 — —
SCHEMBL4584235 0.67 — —
SCHEMBL3811064 0.67 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3830567-A1 DOSIMETER MATERIAL FOR AMMONIA AND/OR AMINES, AND THE PRODUCTION AND USE OF SAME Universität zu Lübeck (DE) 2021-06-09 — — EP claimed
WO-2020021053-A1 DOSIMETER MATERIAL FOR AMMONIA AND/OR AMINES, AND THE PRODUCTION AND USE OF SAME UNIVERSITÄT ZU LÜBECK (DE) 2020-01-30 — — WO claimed
EP-3830567-A1 DOSIMETER MATERIAL FOR AMMONIA AND/OR AMINES, AND THE PRODUCTION AND USE OF SAME Universität zu Lübeck (DE) 2021-06-09 — — EP disclosed
EP-3830567-A1 DOSIMETER MATERIAL FOR AMMONIA AND/OR AMINES, AND THE PRODUCTION AND USE OF SAME Universität zu Lübeck (DE) 2021-06-09 — — EP disclosed
WO-2020021053-A1 DOSIMETER MATERIAL FOR AMMONIA AND/OR AMINES, AND THE PRODUCTION AND USE OF SAME UNIVERSITÄT ZU LÜBECK (DE) 2020-01-30 — — WO disclosed
WO-2020021053-A1 DOSIMETER MATERIAL FOR AMMONIA AND/OR AMINES, AND THE PRODUCTION AND USE OF SAME UNIVERSITÄT ZU LÜBECK (DE) 2020-01-30 — — WO disclosed
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