SCHEMBL79650

SCHEMBL79650

O=C(O)/C=C/c1cccc(F)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 5/20 0.63
NPSR1 Q6W5P4 1/20 0.62
HDAC3 O15379 2/20 0.61
HDAC4 P56524 2/20 0.61
HDAC1 Q13547 2/20 0.61
HDAC7 Q8WUI4 2/20 0.61
HDAC2 Q92769 2/20 0.61
HDAC10 Q969S8 2/20 0.61
HDAC11 Q96DB2 2/20 0.61
HDAC8 Q9BY41 2/20 0.61
HDAC6 Q9UBN7 2/20 0.61
HDAC9 Q9UKV0 2/20 0.61
HDAC5 Q9UQL6 2/20 0.61
TNKS O95271 1/20 0.61
HCAR2 Q8TDS4 1/20 0.61
TNKS2 Q9H2K2 1/20 0.61
MMP1 P03956 2/20 0.55
MMP2 P08253 2/20 0.55
MMP9 P14780 2/20 0.55
MAOA P21397 1/20 0.55

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
SCHEMBL7654865 1.00 NFE2L2 (0.63) NFE2L2NPSR1HDAC3HDAC4HDAC1
SCHEMBL79651 1.00 NFE2L2 (0.63) NFE2L2NPSR1HDAC3HDAC4HDAC1
SCHEMBL30337035 1.00 NFE2L2 (0.63) NFE2L2NPSR1HDAC3HDAC4HDAC1
Guanidine SCHEMBL7159047 0.90 NPSR1 (0.57) NFE2L2NPSR1HDAC3HDAC4HDAC1
Guanidine SCHEMBL7159042 0.90 NPSR1 (0.57) NFE2L2NPSR1HDAC3HDAC4HDAC1
SCHEMBL27746163 0.87 NFE2L2 (0.57) NFE2L2NPSR1HDAC3HDAC4HDAC1
SCHEMBL5598783 0.86 NFE2L2 (0.65) NFE2L2MMP1MMP2MMP9MAOA
SCHEMBL5598785 0.86 NFE2L2 (0.65) NFE2L2MMP1MMP2MMP9MAOA
SCHEMBL271386 0.86 NPSR1 (0.74) NPSR1HDAC3HDAC4HDAC1HDAC7
SCHEMBL69146 0.86 NPSR1 (0.74) NPSR1HDAC3HDAC4HDAC1HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4661890-A1 PTP1B/TC-PTP DUAL INHIBITORS AND PROTEIN DEGRADERS Purdue Research Foundation (US) 2025-12-17 EP claimed
US-12497636-B2 Recombinant Saccharomyces cerevisiae cells for cannabinoid production NATIONAL UNIVERSITY OF SINGAPORE (SG) 2025-12-16 US claimed
WO-2024167565-A1 PTP1B/TC-PTP DUAL INHIBITORS AND PROTEIN DEGRADERS PURDUE RESEARCH FOUNDATION (US) 2024-08-15 WO claimed
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 CN claimed
CN-118027276-A Multipolymer, preparation method and application thereof, negative electrode slurry, negative electrode plate and lithium ion battery 北京卫蓝新能源科技有限公司 2024-05-14 CN claimed
CN-109824294-B High-strength stable liquid accelerator and preparation method thereof 科之杰新材料集团有限公司 2021-08-17 CN claimed
CN-108690609-B Synthesis method of water-soluble or oil-soluble carbon dots and fluorescent carbon dots 中国科学院理化技术研究所 2021-05-14 CN claimed
US-10072043-B2 Inhibitors of protein tyrosine phosphatases INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2018-09-11 US claimed
EP-1526584-B1 Method of forming electroluminescent semiconducting nanocrystal patterned layer for an organic-inorganic hybrid electroluminescent devices, and organic-inorganic hybrid electroluminescent device using the same. SAMSUNG ELECTRONICS CO LTD (KR) 2017-06-14 EP claimed
US-20160176922-A1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASES Indiana University Research and Technology Corpora tion (US) 2016-06-23 US claimed
US-20060020141-A1 Metallized dye XEROX CORPORATION 2006-01-26 US claimed
US-20060000778-A1 high-performance membrane designed for the selective removal of a polar fluid (water) from less polar fluids (organic solvents), by a pervaporation using a composite membrane contaiing ultrafiltration membrane as support ( e.g. cellulose acetate) and a crosslinked copolymer of anionic, cationic monomers MCMASTER UNIVERSITY (CA) 2006-01-05 US claimed
WO-2005102503-A1 PERVAPORATION COMPOSITE MEMBRANES MCMASTER UNIVERSITY (CA) 2005-11-03 WO claimed
US-6946025-B2 Process for preparing tetra-amide compounds XEROX CORPORATION (US) 2005-09-20 US claimed
US-20050161666-A1 Photosensitive semiconductor nanocrystals, photosensitive composition comprising semiconductor nanocrystals and method for forming semiconductor nanocrystal pattern using the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2005-07-28 US claimed
US-20050090690-A1 Process for preparing tetra-amide compounds XEROX CORPORATION 2005-04-28 US claimed
EP-1526584-A2 Photosensitive semiconductor nanocrystals, photosensitive composition comprising semiconductor nanocrystals and method for forming semiconductor nanocrystal pattern using the same Samsung Electronics Co., Ltd (KR) 2005-04-27 EP claimed
EP-1085095-A1 Synthesis of optically active phenylalanine analogs through microbial transformations NSC Technologies Company, L.L.C. (US) 2001-03-21 EP claimed
US-5985927-A Medicaments for the selective treatment of tumor tissues KREUTZ WERNER (DE) 1999-11-16 US claimed
US-5981239-A USING LYASE FROM RHODOTORULA TO INTRODUCE AMMONIA STEREOSPECIFICALLY INTO DOUBLE BOND OF AN ARYLACRYLIC ACID; AMINO ACID FOR USE IN VIRICIDAL PROTEASE INHIBITORS AGAINST HUMAN IMMUNODEFICIENCY VIRUS, INFLUENZA AND OTHERS GREAT LAKES CHEMICAL CORP. (US) 1999-11-09 US claimed

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

For each of this compound's patents that has machine-readable text (4 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-10072043-B2 Inhibitors of protein tyrosine phosphatases PTPRCAP, PTPRF, PTPRS NFE2L2 4821/4885NPSR1 3502/4885HDAC3 3090/4885
US-20160176922-A1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASES PTPRCAP, PTPRF, PTPRS NFE2L2 4821/4885NPSR1 3502/4885HDAC3 3090/4885
US-20060020141-A1 Metallized dye CDYL, CDY1; CDY1B, CDYL2 NFE2L2 1266/4885NPSR1 2989/4885HDAC3 1033/4885
US-20050090690-A1 Process for preparing tetra-amide compounds TAF9, TAF5, TAF1 NFE2L2 3435/4885NPSR1 3033/4885HDAC3 849/4885

“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.