SCHEMBL16970

SCHEMBL16970

CCOC(=O)C(N)Cc1cccc(OC)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NNMT P40261 1/20 0.41
CYP1A2 P05177 3/20 0.41
CYP2C9 P11712 1/20 0.39
HIF1A Q16665 1/20 0.39
ADORA2A P29274 1/20 0.39
TPH1 P17752 2/20 0.39
SCN9A Q15858 1/20 0.38
PSMB5 P28074 1/20 0.38
TGFBR1 P36897 1/20 0.37
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 1/20 0.36
LIPG Q9Y5X9 1/20 0.36
CTSA P10619 1/20 0.36
MPO P05164 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35
KDM1A O60341 1/20 0.35

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
SCHEMBL16971 1.00 NNMT (0.41) NNMTCYP1A2CYP2C9HIF1AADORA2A
SCHEMBL30916085 0.90 ADORA2A (0.42) NNMTCYP1A2ADORA2APSMB5ALDH1A1
SCHEMBL16908 0.80 TP53 (0.41) ADORA2APSMB5ALDH1A1CTSA
SCHEMBL16909 0.80 TP53 (0.41) ADORA2APSMB5ALDH1A1CTSA
SCHEMBL931693 0.78 MAPK1 (0.46) CYP1A2CYP2C9TGFBR1ALDH1A1MAPK1
SCHEMBL1693012 0.77 PTPRA (0.50) CYP1A2CYP2C9HIF1AALDH1A1KDM4E
SCHEMBL27973844 0.77 PTPRA (0.50) CYP1A2CYP2C9HIF1AALDH1A1KDM4E
SCHEMBL10467278 0.77 PTPRA (0.50) CYP1A2CYP2C9HIF1AALDH1A1KDM4E
SCHEMBL3054527 0.77 KMT2A (0.47) CYP1A2ADORA2AALDH1A1KDM4E
SCHEMBL27715009 0.77 KMT2A (0.47) CYP1A2ADORA2AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240174685-A1 OX2R Compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-05-30 US disclosed
US-11905297-B2 OX2R compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-02-20 US disclosed
US-20230122024-A1 OX2R Compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-04-20 US disclosed
US-11479560-B2 OX2R compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2022-10-25 US disclosed
US-11472813-B2 OX2R compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-10-18 US disclosed
US-20210163494-A1 OX2R Compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-06-03 US disclosed
US-20210107914-A1 OX2R Compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-04-15 US disclosed
EP-3773566-A1 OX2R COMPOUNDS Board of Regents, The University of Texas System (US) 2021-02-17 EP disclosed
CN-112165940-A OX2R compound 德克萨斯州立大学董事会 2021-01-01 CN disclosed
WO-2019191327-A1 OX2R COMPOUNDS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2019-10-03 WO disclosed
EP-2609081-A1 SULFONYLPIPERAZINE DERIVATIVES THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES Amgen Inc. (US) 2013-07-03 EP disclosed
US-8431563-B2 Compounds that interact with glucokinase regulatory protein for the treatment of diabetes AMGEN INC. (US) 2013-04-30 US disclosed
US-8431563-B2 Compounds that interact with glucokinase regulatory protein for the treatment of diabetes AMGEN INC. (US) 2013-04-30 US disclosed
US-8431563-B2 Compounds that interact with glucokinase regulatory protein for the treatment of diabetes AMGEN INC. (US) 2013-04-30 US disclosed
US-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-09-06 US disclosed
US-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-09-06 US disclosed
US-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-09-06 US disclosed
WO-2012027261-A1 SULFONYLPIPERAZINE DERIVATIVES THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-03-01 WO disclosed
WO-2012027261-A1 SULFONYLPIPERAZINE DERIVATIVES THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-03-01 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-11479560-B2 OX2R compounds HCRTR2, HCRTR1, OXTR NNMT 3689/4885CYP1A2 772/4885CYP2C9 1329/4885
US-11905297-B2 OX2R compounds HCRTR2, HCRTR1, OXTR NNMT 3689/4885CYP1A2 772/4885CYP2C9 1329/4885
US-20240174685-A1 OX2R Compounds HCRTR2, HCRTR1, OXTR NNMT 3689/4885CYP1A2 772/4885CYP2C9 1329/4885
US-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES GCKR, GCK, SLC5A2 NNMT 4537/4885CYP1A2 2281/4885CYP2C9 1986/4885
US-20210107914-A1 OX2R Compounds HCRTR2, HCRTR1, OXTR NNMT 3689/4885CYP1A2 772/4885CYP2C9 1329/4885
US-20230122024-A1 OX2R Compounds HCRTR2, HCRTR1, OXTR NNMT 3689/4885CYP1A2 772/4885CYP2C9 1329/4885
US-11472813-B2 OX2R compounds HCRTR2, HCRTR1, OXTR NNMT 3689/4885CYP1A2 772/4885CYP2C9 1329/4885
US-20210163494-A1 OX2R Compounds HCRTR2, HCRTR1, OXTR NNMT 3689/4885CYP1A2 772/4885CYP2C9 1329/4885

“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.