SCHEMBL11664637

SCHEMBL11664637

COCCNS(=O)(=O)c1ccc[n+]([O-])c1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 11/20 0.62
▸ LMNA P02545 3/20 0.62
▸ HPGD P15428 2/20 0.62
▸ KDM4E B2RXH2 2/20 0.62
▸ SMN1; SMN2 Q16637 2/20 0.62
▸ NPC1 O15118 1/20 0.62
▸ MAPT P10636 1/20 0.62
▸ RAB9A P51151 1/20 0.62
▸ PKM P14618 4/20 0.58
▸ TSHR P16473 2/20 0.58
▸ POLB P06746 2/20 0.58
▸ MEN1 O00255 1/20 0.58
▸ KMT2A Q03164 1/20 0.58
▸ HTT P42858 4/20 0.56
▸ ALOX15 P16050 1/20 0.56
▸ MAPK1 P28482 1/20 0.55
▸ GAA P10253 2/20 0.52

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
SCHEMBL6567085 0.80 MAPK1 (0.81) ALDH1A1LMNAHPGDKDM4ESMN1; SMN2
SCHEMBL12302132 0.76 ALDH1A1 (0.90) ALDH1A1LMNAHPGDKDM4ESMN1; SMN2
SCHEMBL18770137 0.76 MEN1 (0.38) ALDH1A1LMNASMN1; SMN2PKMMEN1
SCHEMBL31014207 0.74 ALDH1A1 (0.75) ALDH1A1LMNAHPGDKDM4ESMN1; SMN2
SCHEMBL29967391 0.74 ALDH1A1 (0.75) ALDH1A1LMNAHPGDKDM4ESMN1; SMN2
SCHEMBL24762147 0.74 ALDH1A1 (0.75) ALDH1A1LMNAHPGDKDM4ESMN1; SMN2
SCHEMBL2446255 0.74 ALDH1A1 (0.75) ALDH1A1LMNAHPGDKDM4ESMN1; SMN2
SCHEMBL386724 0.74 ALDH1A1 (0.75) ALDH1A1LMNAHPGDKDM4ESMN1; SMN2
SCHEMBL3126117 0.74 ALDH1A1 (0.75) ALDH1A1LMNAHPGDKDM4ESMN1; SMN2
SCHEMBL13159473 0.74 ALDH1A1 (0.94) ALDH1A1LMNAHPGDKDM4ESMN1; SMN2

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
JP-53065881-A — — None — — JP disclosed
JP-S5365881-A PYRIDINE-3-SULFONEAMIDE-1-OXIDE DERIVS. AND ANTICOCCIDIOSIS AGENTS CONTAININGTHE SAME AS ACTIVE CONSTITUENTS SANKYO CO LTD 1978-06-12 — — JP disclosed
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