SCHEMBL26181018

SCHEMBL26181018

O=Cc1cccn1S(=O)(=O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.51
▸ MET P08581 2/20 0.51
▸ KMT2A Q03164 4/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ ACHE P22303 1/20 0.49
▸ LMNA P02545 2/20 0.48
▸ PKM P14618 1/20 0.47
▸ POLB P06746 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ MMP1 P03956 1/20 0.44
▸ MMP2 P08253 1/20 0.44
▸ MMP9 P14780 1/20 0.44
▸ MMP8 P22894 1/20 0.44
▸ MMP13 P45452 1/20 0.44

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
SCHEMBL3968076 0.76 MET (0.47) METKMT2AALDH1A1MEN1
SCHEMBL6534916 0.73 KMT2A (0.61) GAAMETKMT2AALDH1A1MEN1
SCHEMBL8935037 0.72 MET (0.46) GAAMETKMT2AALDH1A1MEN1
SCHEMBL2360974 0.70 ALDH1A1 (0.84) KMT2AALDH1A1MEN1LMNAPKM
SCHEMBL1321811 0.70 KMT2A (0.74) GAAKMT2AALDH1A1POLB
SCHEMBL6419604 0.70 PPME1 (0.67) ALDH1A1PKM
SCHEMBL3310179 0.69 ACHE (0.76) KMT2AALDH1A1MEN1ACHELMNA
SCHEMBL30446303 0.69 KMT2A (1.00) GAAMETKMT2AALDH1A1MEN1
SCHEMBL11566827 0.69 KMT2A (1.00) GAAMETKMT2AALDH1A1MEN1
SCHEMBL2039879 0.69 KMT2A (1.00) GAAMETKMT2AALDH1A1MEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4261830-A1 NOVEL PEPTIDOMIMETIC COMPOUND AND DESIGN Oita University Institute of Advanced Medicine, Inc. (JP) 2023-10-18 — — EP disclosed
CN-116615423-A Novel peptidomimetic compounds and design 株式会社大分大学先端医学研究所 2023-08-18 — — CN disclosed
WO-2022124341-A1 NOVEL PEPTIDOMIMETIC COMPOUND AND DESIGN 株式会社大分大学先端医学研究所 2022-06-16 — — WO disclosed
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