SCHEMBL30895332

SCHEMBL30895332

CN(CCOCCN=[N+]=[N-])S(=O)(=O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ F2 P00734 2/20 0.38
▸ PRSS1 P07477 2/20 0.38
▸ PRSS2 P07478 2/20 0.38
▸ PRSS3 P35030 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.36
▸ PKM P14618 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ MMP1 P03956 1/20 0.36
▸ MMP2 P08253 1/20 0.36
▸ MMP9 P14780 1/20 0.36
▸ MMP8 P22894 1/20 0.36
▸ MMP13 P45452 1/20 0.36
▸ PTPN1 P18031 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36

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
SCHEMBL30895297 0.83 KMT2A (0.59) KMT2AMEN1F2PRSS1PRSS2
SCHEMBL15570039 0.82 KMT2A (0.57) KMT2AMEN1F2PRSS1PRSS2
SCHEMBL31651016 0.82 KMT2A (0.57) KMT2AMEN1F2PRSS1PRSS2
SCHEMBL31651000 0.81 KMT2A (0.56) KMT2AMEN1F2PRSS1PRSS2
SCHEMBL31650988 0.81 KMT2A (0.56) KMT2AMEN1F2PRSS1PRSS2
SCHEMBL31651003 0.81 KMT2A (0.58) KMT2AMEN1F2PRSS1PRSS2
SCHEMBL31651001 0.81 KMT2A (0.58) KMT2AMEN1F2PRSS1PRSS2
SCHEMBL14360829 0.76 KMT2A (0.53) KMT2AMEN1F2PRSS1PRSS2
SCHEMBL31123662 0.76 KMT2A (0.53) KMT2AMEN1F2PRSS1PRSS2
SCHEMBL15570021 0.76 MEN1 (0.53) KMT2AMEN1F2PRSS1PRSS2

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-4578856-A1 HETEROCYCLIC COMPOUND Ubience Inc. (JP) 2025-07-02 — — EP disclosed
WO-2024071371-A1 HETEROCYCLIC COMPOUND ユビエンス株式会社 2024-04-04 — — WO disclosed
Send feedback