SCHEMBL31349269

SCHEMBL31349269

O=[N+]([O-])c1ccc(CN2CCN(c3ccc(Br)cc3)CC2)o1

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.60
▸ GFER P55789 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ IGF1R P08069 1/20 0.48
▸ SLC2A1 P11166 1/20 0.45

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
SCHEMBL31349290 0.87 POLB (0.60) POLBGFERL3MBTL1SLC2A1
SCHEMBL31349213 0.87 POLB (0.60) POLBL3MBTL1
SCHEMBL13219627 0.87 POLB (0.70) POLBGFERL3MBTL1SLC2A1
SCHEMBL31349226 0.85 POLB (0.58) POLBGFERL3MBTL1SLC2A1
SCHEMBL31349225 0.85 POLB (0.58) POLBGFERL3MBTL1SLC2A1
SCHEMBL31349312 0.85 POLB (0.64) POLBGFERL3MBTL1SLC2A1
SCHEMBL31349211 0.84 POLB (0.60) POLBGFERL3MBTL1SLC2A1
SCHEMBL13219624 0.84 POLB (0.60) POLBL3MBTL1
SCHEMBL31349314 0.84 POLB (0.57) POLBGFERL3MBTL1SLC2A1
SCHEMBL31349219 0.84 POLB (0.57) POLBGFERL3MBTL1SLC2A1

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
EP-4743446-A1 NITRO-CONTAINING COMPOUNDS THAT KILL MYCOBACTERIA Board of Trustees of Michigan State University (US) 2026-05-20 — — EP disclosed
WO-2025015066-A1 NITRO-CONTAINING COMPOUNDS THAT KILL MYCOBACTERIA BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2025-01-16 — — WO disclosed
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