SCHEMBL1568079

SCHEMBL1568079

CC(O)N(C)c1ccc(C=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 4/20 0.57
CYP2A13 Q16696 1/20 0.57
ALDH1A1 P00352 7/20 0.48
ALDH1A3 P47895 2/20 0.48
ALDH3A1 P30838 1/20 0.48
TYR P14679 1/20 0.47
ALDH5A1 P51649 1/20 0.41
ABAT P80404 1/20 0.41
KDM4E B2RXH2 1/20 0.38
HSD17B10 Q99714 1/20 0.37
HSD17B3 P37058 1/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
JAK2 O60674 1/20 0.36
MITF O75030 1/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C9 P11712 1/20 0.36

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
SCHEMBL5168126 0.82 CYP2A6 (0.54) CYP2A6CYP2A13ALDH1A1ALDH1A3ALDH3A1
SCHEMBL10936125 0.80 CYP2A6 (0.57) CYP2A6CYP2A13ALDH1A1ALDH1A3ALDH3A1
SCHEMBL28635654 0.79 CYP2A6 (0.52) CYP2A6CYP2A13ALDH1A1ALDH1A3ALDH3A1
SCHEMBL10386781 0.78 ALDH1A1 (0.52) CYP2A6CYP2A13ALDH1A1ALDH1A3ALDH3A1
SCHEMBL8844271 0.77 CYP2A6 (0.48) CYP2A6CYP2A13ALDH1A1ALDH1A3ALDH3A1
SCHEMBL7030860 0.77 ALDH1A1 (0.55) CYP2A6CYP2A13ALDH1A1ALDH1A3ALDH3A1
SCHEMBL8947827 0.76 CYP2A6 (0.52) CYP2A6CYP2A13ALDH1A1ALDH1A3ALDH3A1
SCHEMBL10937910 0.75 CYP2A6 (0.47) CYP2A6CYP2A13ALDH1A1ALDH1A3ALDH3A1
Methyl Alcohol SCHEMBL11054490 0.74 CYP2A6 (0.91) CYP2A6CYP2A13ALDH1A1ALDH1A3ALDH3A1
SCHEMBL29954156 0.74 CYP2A6 (0.67) CYP2A6CYP2A13ALDH1A1ALDH1A3ALDH3A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025028075-A1 TWO-PACK TYPE RESIN COMPOSITION 株式会社日本触媒 2025-02-06 WO disclosed
WO-2024247735-A1 REPAIR METHOD FOR ROADBED DIC株式会社 2024-12-05 WO disclosed
WO-2024232281-A1 THERMOSETTING RESIN COMPOSITION FOR PIPE LINING MATERIAL AND CURED PRODUCT THEREOF DIC株式会社 2024-11-14 WO disclosed
EP-3798244-B1 RESIN COMPOSITION, POLISHING PAD, AND METHOD FOR PRODUCING POLISHING PAD RESONAC CORP (JP) 2024-03-06 EP disclosed
US-20240043674-A1 RUBBER COMPOSITION FOR HOT AIR CROSS-LINKING, CROSS-LINKED RUBBER, AND PRODUCTION METHOD OF CROSS-LINKED RUBBER NOF CORPORATION (JP) 2024-02-08 US disclosed
US-11873399-B2 Resin composition, polishing pad, and method for producing polishing pad RESONAC CORPORATION (JP) 2024-01-16 US disclosed
EP-4265675-A1 RUBBER COMPOSITION FOR HOT AIR CROSS-LINKING, CROSS-LINKED RUBBER, AND PRODUCTION METHOD OF CROSS-LINKED RUBBER NOF Corporation (JP) 2023-10-25 EP disclosed
EP-4245428-A1 PUTTY COATING COMPOSITION Nippon Paint Industrial Coatings Co., Ltd. (JP) 2023-09-20 EP disclosed
WO-2022224988-A1 RECESS FILLING MATERIAL KIT, CURED PRODUCT OF SAME, AND RECESS FILLING METHOD 昭和電工株式会社 2022-10-27 WO disclosed
WO-2022224989-A1 RECESS FILLING MATERIAL KIT, CURED PRODUCT THEREOF, AND METHOD FOR FILLING RECESS 昭和電工株式会社 2022-10-27 WO disclosed
EP-1927603-B1 SYRUP COMPOSITION, RESIN MORTAR COMPOSITION AND APPLICATION METHOD MITSUBISHI RAYON CO (JP) 2011-05-11 EP disclosed
EP-2308907-A1 MOLDING MATERIAL CONTAINING UNSATURATED POLYESTER RESIN AND MICROFIBRILLATED PLANT FIBER Kyoto University (JP) 2011-04-13 EP disclosed
US-20100207078-A1 DEPROTECTION OF FUNCTIONAL GROUPS BY MULTI-PHOTON INDUCED ELECTRON TRANSFER THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2010-08-19 US disclosed
WO-2010034982-A1 LIGANDS FOR AGGREGATED TAU MOLECULES WISTA LABORATORIES LTD. (SG) 2010-04-01 WO disclosed
US-20090047437-A1 SYRUP COMPOSITION, RESIN MORTAR COMPOSITION AND APPLICATION METHOD MITSUBISHI RAYON CO., LTD. (JP) 2009-02-19 US disclosed
EP-1927603-A1 SYRUP COMPOSITION, RESIN MORTAR COMPOSITION AND APPLICATION METHOD Mitsubishi Rayon Co., Ltd. (JP) 2008-06-04 EP disclosed
US-6992140-B2 Curable unsaturated resin composition DAINIPPON INK AND CHEMICALS, INC. (JP) 2006-01-31 US disclosed
US-20040158006-A1 Curable unsaturated resin composition DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-08-12 US disclosed
EP-1400546-A1 CURABLE UNSATURATED RESIN COMPOSITION DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-03-24 EP disclosed
US-5517350-A Optical component based on Langmuir-Blodgett layers HOECHST AKTIENGESELLSCHAFT (DE) 1996-05-14 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 (1 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-20100207078-A1 DEPROTECTION OF FUNCTIONAL GROUPS BY MULTI-PHOTON INDUCED ELECTRON TRANSFER GPX4, ERCC4, CYBA CYP2A6 2829/4885CYP2A13 4685/4885ALDH1A1 947/4885

“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.