SCHEMBL31527690

SCHEMBL31527690

O=[N+]([O-])c1cc(F)ccc1N[SH](=O)=O.[Na]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.49
▸ ATM Q13315 1/20 0.49
▸ KCNMA1 Q12791 1/20 0.48
▸ ALDH3A1 P30838 2/20 0.45
▸ MAPK1 P28482 3/20 0.42
▸ MAPT P10636 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ PDE7A Q13946 1/20 0.40
▸ BCHE P06276 1/20 0.39
▸ ACHE P22303 1/20 0.39
▸ HSPB1 P04792 2/20 0.38
▸ EPAS1 Q99814 4/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ VCAM1 P19320 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HTT P42858 1/20 0.37

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
SCHEMBL31527924 0.80 L3MBTL1 (0.56) TDP1KCNMA1MAPK1MAPTALDH1A1
SCHEMBL4080174 0.79 TDP1 (0.55) TDP1ATMKCNMA1ALDH3A1MAPK1
SCHEMBL30016445 0.77 HCAR3 (0.58) TDP1ATMKCNMA1ALDH3A1MAPK1
SCHEMBL28559787 0.77 TDP1 (0.53) TDP1ATMKCNMA1ALDH3A1MAPK1
SCHEMBL103506 0.77 HCAR3 (0.58) TDP1ATMKCNMA1ALDH3A1MAPK1
SCHEMBL31527695 0.76 MAPT (0.54) TDP1MAPK1MAPTALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL9208634 0.76 TDP1 (0.52) TDP1ATMKCNMA1ALDH3A1MAPK1
SCHEMBL7532814 0.75 TDP1 (0.50) TDP1ATMKCNMA1ALDH3A1MAPK1
SCHEMBL7532822 0.75 TDP1 (0.50) TDP1ATMKCNMA1ALDH3A1MAPK1
SCHEMBL14387881 0.74 MAPT (0.56) TDP1MAPK1MAPTALDH1A1L3MBTL1

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
CN-119968127-A Animal food compositions with improved palatability and customizable properties and methods of making the same 玛氏公司 2025-05-09 — — CN disclosed
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