SCHEMBL3044512

SCHEMBL3044512

[O]c1ccccc1S[N+](=O)[O-]

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE7A Q13946 8/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ LMNA P02545 4/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ MAPT P10636 3/20 0.33
▸ APOBEC3G Q9HC16 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ PKM P14618 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KDM4A O75164 1/20 0.33
▸ TDP2 O95551 1/20 0.33
▸ KDM4C Q9H3R0 1/20 0.33
▸ CA12 O43570 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ TDP1 Q9NUW8 2/20 0.32
▸ GAA P10253 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MAPK1 P28482 1/20 0.32

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
SCHEMBL1336721 0.87 LMNA (0.42) PDE7ASMN1; SMN2LMNAALDH1A1MAPT
SCHEMBL5833149 0.77 PDE7A (0.56) PDE7ASMN1; SMN2LMNAALDH1A1MAPT
SCHEMBL28351783 0.77 LMNA (0.46) PDE7ASMN1; SMN2LMNAALDH1A1MAPT
SCHEMBL3055047 0.77 GPR35 (0.39) PDE7ASMN1; SMN2LMNAALDH1A1MAPT
SCHEMBL3838786 0.77 PDE7A (0.35) PDE7ASMN1; SMN2LMNAALDH1A1MAPT
SCHEMBL8973300 0.74 ALDH1A1 (0.49) SMN1; SMN2LMNAALDH1A1MAPTKMT2A
SCHEMBL4368894 0.73 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1KMT2APKMCA12
SCHEMBL9635033 0.73 APOBEC3G (0.55) SMN1; SMN2ALDH1A1MAPTAPOBEC3GKMT2A
SCHEMBL2461047 0.73 POLB (0.59) SMN1; SMN2LMNAALDH1A1MAPTKMT2A
SCHEMBL31163274 0.73 POLB (0.59) SMN1; SMN2LMNAALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431699-B2 Method for manufacture of 2-oxoimidazolidines Vertichem Corporation (CA) 2013-04-30 — — US disclosed
WO-2010099518-A2 METHOD FOR MANUFACTURE OF 2-OXOIMIDAZOLIDINES THESIS CHEMISTRY, LLC (US) 2010-09-02 — — WO disclosed
WO-2010099029-A1 EPOXY COMPOSITIONS WITH IMPROVED MECHANICAL PERFORMANCE CYTEC TECHNOLOGY CORP. (US) 2010-09-02 — — WO disclosed
US-20100222461-A1 EPOXY COMPOSITIONS WITH IMPROVED MECHANICAL PERFORMANCE CYTEC TECHNOLOGY CORP. (US) 2010-09-02 — — US disclosed
US-20100222588-A1 Method for Manufacture of 2-Oxoimidazolidines THESIS CHEMISTRY, LLC (US) 2010-09-02 — — US disclosed
US-6627714-B2 Copolymerizing ethylene and dicyclopentadiene or tricyclopentadiene, and cyclic olefin in presence of metallocene catalyst to produce copolymer MARUZEN PETROCHEMICAL CO., LTD. (JP) 2003-09-30 — — US disclosed
US-20020058767-A1 Method for producing an olefin type copolymer having a cyclic structure MARUZEN PETROCHEMICAL CO., LTD. (JP) 2002-05-16 — — US disclosed
EP-1205497-A2 Method for producing an olefin type copolymer having a cyclic structure MARUZEN PETROCHEMICAL CO., LTD. (JP) 2002-05-15 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100222588-A1 Method for Manufacture of 2-Oxoimidazolidines ODC1, CBR3, CBR1 PDE7A 711/4885SMN1; SMN2 4607/4885LMNA 1107/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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