SCHEMBL76489

SCHEMBL76489

O=C(NC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.67
ALOX15 P16050 2/20 0.67
HDAC3 O15379 1/20 0.67
CA12 O43570 1/20 0.67
CA1 P00915 1/20 0.67
IDO1 P14902 1/20 0.67
HDAC1 Q13547 1/20 0.67
CA9 Q16790 1/20 0.67
HDAC7 Q8WUI4 1/20 0.67
HDAC2 Q92769 1/20 0.67
HSD17B10 Q99714 1/20 0.67
HDAC8 Q9BY41 1/20 0.67
HDAC6 Q9UBN7 1/20 0.67
NCOR2 Q9Y618 1/20 0.67
NPC1 O15118 3/20 0.64
RAB9A P51151 3/20 0.64
KMT2A Q03164 3/20 0.64
MEN1 O00255 2/20 0.64
GAA P10253 3/20 0.61
EPHX1 P07099 2/20 0.59

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
Hydrochloric Acid SCHEMBL27693713 0.97 ALDH1A1 (0.64) ALDH1A1ALOX15HDAC3CA12CA1
Biphenyl SCHEMBL27419692 0.92 NPC1 (0.68) ALDH1A1ALOX15HDAC3CA12CA1
Phosphoric Acid SCHEMBL28452050 0.92 ALDH1A1 (0.59) ALDH1A1ALOX15HDAC3CA12CA1
Phosphoric Acid SCHEMBL28371261 0.92 ALDH1A1 (0.59) ALDH1A1ALOX15HDAC3CA12CA1
SCHEMBL28362828 0.89 ALDH1A1 (0.61) ALDH1A1ALOX15HDAC3CA12CA1
SCHEMBL6340484 0.89 RAB9A (0.72) ALDH1A1ALOX15HDAC3CA12CA1
SCHEMBL8983164 0.89 ALDH1A1 (0.61) ALDH1A1ALOX15HDAC3CA12CA1
SCHEMBL1005988 0.89 ALDH1A1 (0.61) ALDH1A1ALOX15HDAC3CA12CA1
SCHEMBL25489176 0.88 HDAC8 (0.61) ALDH1A1ALOX15HDAC3CA12CA1
Chlorobenzene SCHEMBL28816973 0.88 NPC1 (0.61) ALDH1A1ALOX15HDAC3CA12CA1

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 1157 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119350725-A Lignin/carbon black/natural rubber composite material and preparation method and application thereof 华南理工大学 2025-01-24 CN claimed
CN-119039684-A Polymer-based PTC composite material based on pi-pi interaction, preparation method and application 四川大学 2024-11-29 CN claimed
CN-118459988-A High-modulus carbon fiber nylon composite material and preparation method thereof 烟台奥森制动材料有限公司 2024-08-09 CN claimed
WO-2024083012-A1 LITHIUM ION ELECTROLYTIC SOLUTION, GEL POLYMER ELECTROLYTE, AND LITHIUM ION BATTERY 张家港市国泰华荣化工新材料有限公司 2024-04-25 WO claimed
EP-3887368-B1 3/4-((2E,6E)-3,7,11-TRIMETHYLDODECA-2,6,10-TRIENYLTHIO)BENZAMIDE DERIVATIVE COMPOUNDS ANKARA UENIVERSITESI REKTOERLUEGUE (TR) 2023-12-06 EP claimed
EP-3310822-B1 PROCATALYST FOR POLYMERIZATION OF OLEFINS COMPRISING AN AMINOBENZOATE INTERNAL DONOR AND A 1,3-DIETHER INTERNAL DONOR IN A SPECIFIC RATIO SABIC GLOBAL TECHNOLOGIES BV (NL) 2023-10-11 EP claimed
WO-2023108322-A1 SOLID ELECTROLYTE HAVING MECHANICAL GRADIENT AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 深圳先进技术研究院 2023-06-22 WO claimed
CN-115735919-A Herbicide composition containing cyclohexane-1, 3-dione derivative and application thereof 郑州手性药物研究院有限公司 2023-03-07 CN claimed
WO-2022120660-A1 ASYMMETRIC SOLID ELECTROLYTE AND PREPARATION METHOD THEREFOR, AND SOLID LITHIUM BATTERY AND PREPARATION METHOD THEREFOR 中国科学院深圳先进技术研究院 2022-06-16 WO claimed
CN-108368531-B Improved recombinant production method 豪夫迈·罗氏有限公司 2022-03-25 CN claimed
EP-0875787-A1 Method for reducing the substrate dependence of resist Wako Pure Chemical Industries, Ltd. (JP) 1998-11-04 EP claimed
WO-1998041093-A1 DIARYL ETHERS AND PROCESSES FOR THEIR PREPARATION AND HERBICIDAL AND DESICCANT COMPOSITIONS CONTAINING THEM ISK AMERICAS INCORPORATED (US) 1998-09-24 WO claimed
WO-1998038168-A1 ISOQUINOLINONE DERIVATIVES, PROCESS FOR PREPARING THE SAME, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS TANABE SEIYAKU CO., LTD. (JP) 1998-09-03 WO claimed
EP-0093465-B1 PREPARATION OF 6-ALPHA-BROMO- AND/OR 6,6-DIBROMO-PENICILLANIC ACID 1,1-DIOXIDES GIST-BROCADES N.V. (NL) 1987-05-06 EP claimed
EP-0093465-A2 Preparation of 6-alpha-bromo- and/or 6,6-dibromo-penicillanic acid 1,1-dioxides GIST-BROCADES N.V. (NL) 1983-11-09 EP claimed
US-4369207-A PHOTOPOLYMERIZING TEIJIN LIMITED (JP) 1983-01-18 US claimed
EP-0000705-B1 USE OF ESTERS OR AMIDES OF BENZOYLBENZOIC ACIDS AS PHOTOINITIATORS AND PHOTOPOLYMERISABLE COMPOSITION CONTAINING THEM STAUFFER CHEMICAL COMPANY (US) 1981-02-11 EP claimed
US-4213784-A Process for producing heat developable light-sensitive compositions and elements FUJI PHOTO FILM CO., LTD. (JP) 1980-07-22 US claimed
EP-0000705-A1 Use of esters or amides of benzoylbenzoic acids as photoinitiators and photopolymerisable composition containing them STAUFFER CHEMICAL COMPANY (US) 1979-02-21 EP claimed
US-4080275-A POLYMERIZATION INITIATOR, ETHYLENICALLY UNSATURATED MONOMER STAUFFER CHEMICAL COMPANY (US) 1978-03-21 US claimed