SCHEMBL2742575

SCHEMBL2742575

NC(=O)Cc1ccc(O)c([N+](=O)[O-])c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.58
NPSR1 Q6W5P4 1/20 0.58
MAPK1 P28482 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
ALOX15 P16050 1/20 0.54
HSD17B10 Q99714 1/20 0.54
POLB P06746 1/20 0.52
CA2 P00918 2/20 0.51
ALDH1A1 P00352 2/20 0.51
TP53 P04637 1/20 0.51
HPGD P15428 1/20 0.51
TSHR P16473 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
GPR35 Q9HC97 1/20 0.51
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA9 Q16790 1/20 0.51
GRM4 Q14833 1/20 0.49
ALDH5A1 P51649 1/20 0.47
ABAT P80404 1/20 0.47

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
SCHEMBL5184754 0.87 GPR35 (0.51) MAPTNPSR1MAPK1L3MBTL1ALOX15
SCHEMBL4684043 0.86 CASP6 (0.49) MAPTNPSR1MAPK1CA2ALDH1A1
SCHEMBL2710180 0.85 MAPT (0.59) MAPTNPSR1MAPK1L3MBTL1ALOX15
SCHEMBL231627 0.85 MAPT (0.59) MAPTNPSR1MAPK1L3MBTL1ALOX15
SCHEMBL10665444 0.83 TSHR (0.54) MAPTALOX15POLBCA2ALDH1A1
SCHEMBL7126615 0.83 POLB (0.52) MAPTNPSR1MAPK1L3MBTL1ALOX15
SCHEMBL13520189 0.83 POLB (0.52) MAPTNPSR1MAPK1L3MBTL1ALOX15
SCHEMBL7564083 0.83 POLB (0.52) MAPTNPSR1MAPK1L3MBTL1ALOX15
SCHEMBL2645028 0.82 VCAM1 (0.54) MAPTPOLBALDH1A1HPGDSMN1; SMN2
SCHEMBL3131783 0.82 LMNA (0.54) MAPTNPSR1CA2ALDH1A1SMN1; 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150140573-A1 ASSAYS FOR DETECTING GLUCOSIDASE ACTIVITY MEGAZYME INTERNATIONAL IRELAND (IE) 2015-05-21 US claimed
WO-2013185771-A1 ASSAYS FOR DETECTING GLUCOSIDASE ACTIVITY CARLSBERG A/S, CARLSBERG FORSKNINGSCENTER (DK) 2013-12-19 WO claimed
WO-2020004521-A1 THERAPEUTIC AGENT FOR INFLAMMATORY DISEASES, AUTOIMMUNE DISEASES, FIBROTIC DISEASES, AND CANCER DISEASES Meiji Seikaファルマ株式会社 2020-01-02 WO disclosed
US-8710071-B2 Compounds, compositions and methods for reducing lipid levels CVI PHARMACEUTICALS LIMITED (KY) 2014-04-29 US disclosed
US-20120004223-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR REDUCING LIPID LEVELS CVI PHARMACEUTICALS LIMITED (KY) 2012-01-05 US disclosed
US-20110009628-A1 Compounds and Compositions for Modulating Lipid Levels and Methods of Preparing Same CVI PHARMACEUTICALS LIMITED (KY) 2011-01-13 US disclosed
US-4016193-A ANALGESICS, ANTIINFLAMMATORY AGENTS MITSUBISHI YUKA PHARMACEUTICAL CO., LTD. (JA) 1977-04-05 US 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 (2 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-20110009628-A1 Compounds and Compositions for Modulating Lipid Levels and Methods of Preparing Same LIPC, LDLR, PCSK9 MAPT 3477/4885NPSR1 1767/4885MAPK1 828/4885
US-20120004223-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR REDUCING LIPID LEVELS LIPC, LDLR, PCSK9 MAPT 3124/4885NPSR1 1527/4885MAPK1 984/4885

“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.