SCHEMBL32659996

SCHEMBL32659996

O=C(c1ccc(NC2CCCCC2)c([N+](=O)[O-])c1)N1CCC(F)CC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HCAR3 P49019 3/20 0.67
▸ LMNA P02545 6/20 0.51
▸ ALDH1A1 P00352 3/20 0.51
▸ MAPT P10636 3/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ L3MBTL3 Q96JM7 1/20 0.51
▸ HTT P42858 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ EPHX2 P34913 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ GPR55 Q9Y2T6 1/20 0.50
▸ SLC6A9 P48067 1/20 0.49
▸ SLC6A5 Q9Y345 1/20 0.49
▸ WNK1 Q9H4A3 2/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ HPGD P15428 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL32659998 0.90 HCAR3 (0.65) HCAR3LMNAALDH1A1MAPTL3MBTL1
SCHEMBL32660008 0.89 HCAR3 (0.67) HCAR3LMNAALDH1A1MAPTL3MBTL1
SCHEMBL32660021 0.85 EPHX2 (0.49) HCAR3LMNAALDH1A1L3MBTL1L3MBTL3
SCHEMBL32660058 0.83 HCAR3 (0.59) HCAR3LMNAALDH1A1MAPTL3MBTL1
SCHEMBL2030586 0.82 HCAR3 (0.97) HCAR3LMNAALDH1A1MAPTMAPK1
SCHEMBL32660012 0.81 ALOX15 (0.57) LMNAALDH1A1MAPTL3MBTL1L3MBTL3
SCHEMBL6043899 0.81 HCAR3 (1.00) HCAR3LMNAALDH1A1MAPTMAPK1
SCHEMBL1725095 0.78 HCAR3 (0.80) HCAR3LMNAALDH1A1MAPTMAPK1
SCHEMBL6044949 0.78 HCAR3 (1.00) HCAR3LMNAMAPTMAPK1KMT2A
SCHEMBL25782087 0.78 HCAR3 (0.74) HCAR3LMNAALDH1A1MAPTL3MBTL1

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
EP-4678633-A1 NOVEL FERROPTOSIS INHIBITORS Universiteit Antwerpen (BE) 2026-01-14 — — EP disclosed
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