SCHEMBL117688

SCHEMBL117688

CC(C)(O)C(C)(C)OB(O)c1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.43
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ORAI1 Q96D31 1/20 0.38
ORAI2 Q96SN7 1/20 0.38
ORAI3 Q9BRQ5 1/20 0.38
TRPV6 Q9H1D0 1/20 0.38
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C19 P33261 1/20 0.33
PPARA Q07869 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
HIF1A Q16665 1/20 0.32
POLB P06746 1/20 0.32
PDK1 Q15118 1/20 0.30
PDK2 Q15119 1/20 0.30

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
SCHEMBL19433226 0.85 CA2 (0.42) ENPP2TSHR
SCHEMBL3681691 0.83 CA2 (0.45) MEN1KMT2AORAI1ORAI2ORAI3
SCHEMBL1181137 0.83 ENPP2 (0.41) ENPP2MEN1KMT2ACYP3A4MAPT
SCHEMBL9903022 0.81
SCHEMBL5510320 0.81 TRPV1 (0.40) ORAI1ORAI2ORAI3TRPV6MAPT
SCHEMBL54815 0.81 MAPK1 (0.32) MAPTMAPK1
SCHEMBL3711217 0.81
SCHEMBL119711 0.81 TRPV6 (0.39) ENPP2ORAI1ORAI2ORAI3TRPV6
SCHEMBL366006 0.80 CA1 (0.52) ENPP2MAPK1PDK1PDK2PDK3
SCHEMBL4592239 0.80 PGR (0.35) ENPP2ORAI1ORAI2ORAI3TRPV6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116253755-A Synthesis method of diaryl borate compound 湖南大学 2023-06-13 CN claimed
US-20260014125-A1 BICYCLIC-TYPE MAT2A INHIBITOR AND USE THEREOF HAIHE BIOPHARMA CO LTD (CN) 2026-01-15 US disclosed
EP-4556475-A1 BICYCLIC-TYPE MAT2A INHIBITOR AND USE THEREOF Haihe Biopharma Co., Ltd. (CN) 2025-05-21 EP disclosed
EP-3626241-B1 DEUTERATED N-BENZENESULFONYLBENZAMIDE COMPOUND FOR INHIBITING BCL-2 PROTEIN AND COMPOSITION AND USE THEREOF SHENZHEN TARGETRX INC (CN) 2025-04-23 EP disclosed
CN-119403802-A Di-parallel ring MAT2A inhibitor and application thereof 上海海和药物研究开发股份有限公司 2025-02-07 CN disclosed
CN-113851599-B Organic electroluminescent device and display device comprising same 烟台显华光电材料研究院有限公司 2024-08-13 CN disclosed
CN-113725383-B Organic electroluminescent device and display device comprising same 烟台显华光电材料研究院有限公司 2024-04-19 CN disclosed
CN-117430596-A Di-parallel ring MAT2A inhibitor and application thereof 上海海和药物研究开发股份有限公司 2024-01-23 CN disclosed
WO-2024012507-A1 BICYCLIC-TYPE MAT2A INHIBITOR AND USE THEREOF 上海海和药物研究开发股份有限公司 2024-01-18 WO disclosed
US-11718611-B2 Benzenesulfonylbenazamide compound for inhibiting BCL-2 protein and composition and use thereof SHENZHEN TARGETRX, INC. (CN) 2023-08-08 US disclosed
EP-2781519-A1 NOVEL ANTIVIRAL PYRROLOPYRIDINE DERIVATIVE AND A PRODUCTION METHOD FOR SAME Korea Research Institute of Chemical Technology (KR) 2014-09-24 EP disclosed
CN-104066732-A Novel antiviral pyrrolopyridine derivative and a production method for same KOREA RES INST CHEM TECH 2014-09-24 CN disclosed
US-20140249162-A1 NOVEL ANTIVIRAL PYRROLOPYRIDINE DERIVATIVES AND METHOD FOR PREPARING THE SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2014-09-04 US disclosed
US-20120115724-A1 METHOD OF CONTROLLING UNDESIRED VEGETATION SYNGENTA CROP PROTECTION LLC (US) 2012-05-10 US disclosed
EP-2424367-A1 METHOD OF CONTROLLING UNDESIRED VEGETATION Syngenta Limited (GB) 2012-03-07 EP disclosed
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 US disclosed
CN-101938905-A Chemical compounds SYNGENTA LTD 2011-01-05 CN disclosed
WO-2010125332-A1 METHOD OF CONTROLLING UNDESIRED VEGETATION SYNGENTA LIMITED (GB) 2010-11-04 WO disclosed
EP-2237669-A2 CHEMICAL COMPOUNDS Syngenta Limited (GB) 2010-10-13 EP disclosed
WO-2009081112-A2 CHEMICAL COMPOUNDS SYNGENTA LIMITED (GB) 2009-07-02 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 (5 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-11718611-B2 Benzenesulfonylbenazamide compound for inhibiting BCL-2 protein and composition and use thereof BCL2, BCL2L1, BCL2L2 ENPP2 2621/4885MEN1 3979/4885KMT2A 779/4885
US-20110086759-A1 CHEMICAL COMPOUNDS DDT, PNPO, CBR3 ENPP2 3553/4885MEN1 3860/4885KMT2A 2003/4885
US-20260014125-A1 BICYCLIC-TYPE MAT2A INHIBITOR AND USE THEREOF MAT2A, MNAT1, MAT1A ENPP2 2474/4885MEN1 589/4885KMT2A 124/4885
US-20140249162-A1 NOVEL ANTIVIRAL PYRROLOPYRIDINE DERIVATIVES AND METHOD FOR PREPARING THE SAME MAVS, IMPDH1, SARS1 ENPP2 4040/4885MEN1 4611/4885KMT2A 4376/4885
US-20120115724-A1 METHOD OF CONTROLLING UNDESIRED VEGETATION TYMS, DHFR, UNG ENPP2 4085/4885MEN1 4635/4885KMT2A 1950/4885

“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.