SCHEMBL166545

SCHEMBL166545

O=C=NC1CCC(C(N=C=O)C2CCCCC2)CC1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.57
EPHX1 P07099 1/20 0.35
HIF1A Q16665 1/20 0.35
APLNR P35414 1/20 0.32

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
SCHEMBL4272292 0.92 ALDH1A1 (0.48) ALDH1A1APLNR
SCHEMBL939785 0.86 ALDH1A1 (0.42) ALDH1A1EPHX1
SCHEMBL2768891 0.86 ALDH1A1 (0.42) ALDH1A1EPHX1
SCHEMBL7620891 0.84 ALDH1A1 (0.52) ALDH1A1EPHX1HIF1A
SCHEMBL28571200 0.80 ALDH1A1 (0.38) ALDH1A1EPHX1
SCHEMBL11208841 0.77 ALDH1A1 (0.35) ALDH1A1
Cyclohexane SCHEMBL28340312 0.77 ALDH1A1 (0.83) ALDH1A1EPHX1HIF1AAPLNR
SCHEMBL28120054 0.76 ALDH1A1 (0.48) ALDH1A1APLNR
SCHEMBL3891086 0.75 ALDH1A1 (0.89) ALDH1A1EPHX1HIF1AAPLNR
SCHEMBL19645458 0.75 ALDH1A1 (1.00) ALDH1A1EPHX1HIF1AAPLNR

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

Appears in 3378 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115232256-B Preparation method of high-resilience polymer polyol, polymer polyol obtained by preparation method and application 中国石油化工股份有限公司 2024-07-23 CN claimed
CN-118355088-A Moisture-curable polyurethane hot melt adhesive compositions 汉高股份有限及两合公司 2024-07-16 CN claimed
CN-118344559-A Water-based closed isocyanate composition and preparation method and application thereof 广州冠志新材料科技有限公司 2024-07-16 CN claimed
CN-118325031-A Amino compound modified polyurethane elastomer and preparation method thereof 北京理工大学 2024-07-12 CN claimed
CN-118307444-A Method for reducing chlorine-containing impurities in isocyanate 山东新和成精化科技有限公司 2024-07-09 CN claimed
CN-118290702-A Polyisocyanate composition and preparation method thereof 万华化学(宁波)有限公司 2024-07-05 CN claimed
CN-118290693-A Self-healing aqueous polyurethane with anti-corrosion function and preparation method thereof 昆山嘉力普制版胶粘剂油墨有限公司 2024-07-05 CN claimed
CN-115785889-B Polyurethane adhesive for single-sided adhesive shoes and preparation method thereof 福建华夏蓝新材料科技有限公司 2024-07-05 CN claimed
CN-118290660-A Photo-curing 3D printing material and preparation method thereof 万华化学集团股份有限公司 2024-07-05 CN claimed
CN-118290690-A Thermoplastic polyurethane for large-caliber extrusion and preparation method thereof 万华化学集团股份有限公司 2024-07-05 CN claimed
CN-108058468-B Preparation method of temperature-sensitive color-changing luminous polyurethane synthetic leather 四川大学 2019-12-20 CN claimed
CN-110563916-A PPC resin derivative and online preparation method thereof 江苏中科金龙环保新材料有限公司 2019-12-13 CN claimed
CN-110563922-A Chemical crosslinking type high-performance room-temperature rapid self-repairing flexible material and preparation method and application thereof 四川大学 2019-12-13 CN claimed
CN-110563976-A Method of making a polymeric article and the resulting article 诺贝尔科学有限公司 2019-12-13 CN claimed
CN-110563917-A Online modified PPC resin and preparation process thereof 江苏中科金龙环保新材料有限公司 2019-12-13 CN claimed
CN-110563913-A High heat-resistant thermoplastic polyurethane elastomer and preparation method thereof 山东一诺威聚氨酯股份有限公司 2019-12-13 CN claimed
CN-110551269-A Heat-resistant room-temperature rapid self-repairing elastomer and preparation method and application thereof UNIV SICHUAN 2019-12-10 CN claimed
CN-110540665-A Solvent-free heat-insulating polyurethane film and preparation method and application thereof CHINA BUILDING MAT ACADEMY 2019-12-06 CN claimed
CN-1278281-A Method for forming integral skin flexible foams from high purity cyclopentane and blend thereof EXXON CHEMICAL PATENTS INC (US) 2000-12-27 CN claimed
US-6127029-A SURFACE-TREATED REINFORCING MATERIAL WHICH CAN PRODUCE A COMPOSITE MATERIAL COMPRISING MATRIX AND SURFACE-TREATED REINFORCING MATERIAL AND HAVING HIGH ADHESIVITY BETWEEN THE TWO COMPONENTS NISSHINBO INDUSTRIES, INC. (JP) 2000-10-03 US claimed