SCHEMBL31006695

SCHEMBL31006695

C[C@@H]1CCCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ HPGD P15428 4/20 0.49
▸ GAA P10253 1/20 0.49
▸ ALDH1A1 P00352 3/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ POLB P06746 2/20 0.43
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA7 P43166 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ CA14 Q9ULX7 1/20 0.43
▸ LMNA P02545 2/20 0.42
▸ MAPT P10636 1/20 0.42
▸ MAPK1 P28482 2/20 0.41
▸ PDK2 Q15119 1/20 0.41
▸ HSD11B1 P28845 1/20 0.40

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
SCHEMBL30009432 0.81 HPGD (0.69) MEN1KMT2AHPGDGAAALDH1A1
SCHEMBL13753553 0.81 RXFP1 (0.60) MEN1KMT2AHPGDGAAALDH1A1
SCHEMBL13753526 0.80 HPGD (0.68) MEN1KMT2AHPGDGAAALDH1A1
SCHEMBL27424708 0.79 HPGD (0.54) MEN1KMT2AHPGDGAAALDH1A1
SCHEMBL16169924 0.78 GAA (0.59) MEN1KMT2AHPGDGAAALDH1A1
SCHEMBL13761333 0.77 HPGD (0.51) MEN1KMT2AHPGDGAAPOLB
SCHEMBL13753558 0.77 HPGD (0.51) MEN1KMT2AHPGDGAAPOLB
SCHEMBL21697075 0.75 GAA (0.59) MEN1KMT2AHPGDGAAMAPK1
SCHEMBL22054772 0.75 GAA (0.59) MEN1KMT2AHPGDGAAMAPK1
SCHEMBL20370207 0.74 GAA (0.76) KMT2AHPGDGAAALDH1A1POLB

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-4638424-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION Pretzel Therapeutics, Inc. (US) 2025-10-29 — — EP disclosed
WO-2024137813-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION PRETZEL THERAPEUTICS, INC. (US) 2024-06-27 — — WO disclosed
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