SCHEMBL443319

SCHEMBL443319

CC(C)c1noc(CN)n1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.38
NOTUM Q6P988 1/20 0.38
GPR119 Q8TDV5 1/20 0.35
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL669615 0.83 HSD11B1 (0.34) HSD11B1GPR119
Hydrochloric Acid SCHEMBL3716898 0.82 HSD11B1 (0.33) HSD11B1GPR119
SCHEMBL20878703 0.82 NOTUM (0.35) NOTUM
SCHEMBL7655000 0.80 HSD11B1 (0.36) HSD11B1GPR119MAOAMAOBMEN1
SCHEMBL23791454 0.78 HSD11B1 (0.35) HSD11B1GPR119MAOAMAOBMEN1
SCHEMBL15110040 0.78 HSD11B1 (0.35) HSD11B1GPR119MAOAMAOBMEN1
SCHEMBL7602702 0.78 KDM4E (0.35) HSD11B1GPR119MAOAMAOBMEN1
SCHEMBL461807 0.78 HSD11B1 (0.35) HSD11B1GPR119MAOAMAOBMEN1
SCHEMBL1091053 0.78 NOTUM (0.40) HSD11B1NOTUMGPR119MAOAMAOB
SCHEMBL4269099 0.78 HSD11B1 (0.35) HSD11B1GPR119MAOAMAOBMEN1

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10357546-B2 Acceleration of diabetic wound healing UNIVERSITY OF NOTRE DAME DU LAC (US) 2019-07-23 US disclosed
US-10253013-B2 Selective matrix metalloproteinase inhibitors UNIVERSITY OF NOTRE DAME DU LAC (US) 2019-04-09 US disclosed
US-9951035-B2 Selective matrix metalloproteinase inhibitors UNIVERSITY OF NOTRE DAME DU LAC (US) 2018-04-24 US disclosed
US-9951035-B2 Selective matrix metalloproteinase inhibitors UNIVERSITY OF NOTRE DAME DU LAC (US) 2018-04-24 US disclosed
US-20170274053-A1 ACCELERATION OF DIABETIC WOUND HEALING UNIVERSITY OF NOTRE DAME DU LAC (US) 2017-09-28 US disclosed
US-20170274053-A1 ACCELERATION OF DIABETIC WOUND HEALING UNIVERSITY OF NOTRE DAME DU LAC (US) 2017-09-28 US disclosed
US-20170218000-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS ARIAD PHARMACEUTICALS, INC. 2017-08-03 US disclosed
US-20170190685-A1 SELECTIVE MATRIX METALLOPROTEINASE INHIBITORS UNIVERSITY OF NOTRE DAME DU LAC (US) 2017-07-06 US disclosed
US-20170190685-A1 SELECTIVE MATRIX METALLOPROTEINASE INHIBITORS UNIVERSITY OF NOTRE DAME DU LAC (US) 2017-07-06 US disclosed
US-9604957-B2 Selective matrix metalloproteinase inhibitors UNIVERSITY OF NOTRE DAME DU LAC (US) 2017-03-28 US disclosed
US-20120065212-A1 HETEROARYLMETHYL AMIDES F. HOFFMANN-LA ROCHE AG (CH) 2012-03-15 US disclosed
WO-2012032018-A1 HETEROARYLMETHYL AMIDES F. HOFFMANN-LA ROCHE AG (CH) 2012-03-15 WO disclosed
US-20110237564-A1 IMIDAZOPYRIMIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. 2011-09-29 US disclosed
WO-2011117264-A1 N-(IMIDAZOPYRIMIDIN-7-YL)-HETEROARYLAMIDE DERIVATIVES AND THEIR USE AS PDE10A INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-09-29 WO disclosed
US-20100256097-A1 INHIBITORS OF JANUS KINASES MERCK SHARP & DOHME LLC 2010-10-07 US disclosed
US-20100256097-A1 INHIBITORS OF JANUS KINASES MERCK SHARP & DOHME LLC 2010-10-07 US disclosed
US-20100256097-A1 INHIBITORS OF JANUS KINASES MERCK SHARP & DOHME LLC 2010-10-07 US disclosed
EP-2166846-A1 INHIBITORS OF JANUS KINASES Merck Sharp & Dohme Corp. (US) 2010-03-31 EP disclosed
WO-2008156726-A1 INHIBITORS OF JANUS KINASES MERCK & CO., INC. (US) 2008-12-24 WO disclosed
WO-2008156726-A1 INHIBITORS OF JANUS KINASES MERCK & CO., INC. (US) 2008-12-24 WO 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 (8 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-10253013-B2 Selective matrix metalloproteinase inhibitors MMP14, MMP9, MMP13 HSD11B1 915/4885NOTUM 3181/4885GPR119 1265/4885
US-20170218000-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS MAP3K6, PIK3CA, MAP3K20 HSD11B1 2582/4885NOTUM 3121/4885GPR119 1314/4885
US-20110237564-A1 IMIDAZOPYRIMIDINE DERIVATIVES PDE5A, PDE3B, PDE3A HSD11B1 914/4885NOTUM 2228/4885GPR119 69/4885
US-20100256097-A1 INHIBITORS OF JANUS KINASES JAK2, JAK3, JAK1 HSD11B1 2855/4885NOTUM 4195/4885GPR119 1348/4885
US-20170274053-A1 ACCELERATION OF DIABETIC WOUND HEALING MMP8, MMP9, MMP1 HSD11B1 1593/4885NOTUM 1758/4885GPR119 289/4885
US-20170190685-A1 SELECTIVE MATRIX METALLOPROTEINASE INHIBITORS MMP14, MMP9, MMP13 HSD11B1 915/4885NOTUM 3181/4885GPR119 1265/4885
US-20120065212-A1 HETEROARYLMETHYL AMIDES APOB, LDLR, HMGCR HSD11B1 364/4885NOTUM 391/4885GPR119 48/4885
US-10357546-B2 Acceleration of diabetic wound healing MMP8, MMP9, MMP1 HSD11B1 1593/4885NOTUM 1758/4885GPR119 289/4885

“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.