SCHEMBL31349278

SCHEMBL31349278

CN(C)C(=O)N1CCN(Cc2ccc([N+](=O)[O-])o2)CC1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.57
▸ ALDH1A1 P00352 4/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ LMNA P02545 2/20 0.41
▸ HRH3 Q9Y5N1 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL31349220 0.86 POLB (0.56) POLBALDH1A1NPSR1KDM4EMAPT
SCHEMBL31349303 0.84 POLB (0.56) POLBALDH1A1NPSR1KDM4EMAPT
SCHEMBL13219632 0.81 POLB (0.64) POLBALDH1A1NPSR1KDM4EMAPT
SCHEMBL31349287 0.81 POLB (0.56) POLBALDH1A1NPSR1KDM4EMAPT
SCHEMBL31349234 0.80 POLB (0.55) POLBNPSR1MAPTLMNAL3MBTL1
SCHEMBL31349325 0.80 POLB (0.58) POLBALDH1A1NPSR1KDM4EMAPT
SCHEMBL31349324 0.77 FAAH (0.58) POLBKDM4EMAPT
SCHEMBL31349260 0.76 KDM4E (0.56) POLBNPSR1KDM4EHRH3L3MBTL1
SCHEMBL13219626 0.76 POLB (0.65) POLBALDH1A1KDM4EMAPTLMNA
SCHEMBL31349289 0.76 POLB (0.58) POLBALDH1A1NPSR1MAPTL3MBTL1

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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