SCHEMBL109897

SCHEMBL109897

CC(C)(N=C=O)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP2C19 P33261 1/20 0.38
HIF1A Q16665 1/20 0.38
ALDH1A1 P00352 3/20 0.37
TAAR1 Q96RJ0 1/20 0.37
ALOX15 P16050 1/20 0.37
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36
ESR1 P03372 2/20 0.35

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
SCHEMBL28238 0.88 GABRA1 (0.32) CYP3A4TSHR
SCHEMBL34924 0.84 ESR1 (0.36) HDAC4HDAC2HDAC8ESR1ESR2
SCHEMBL6266620 0.84 CYP3A4 (0.38) MAPK1MAPTKMT2ATAAR1CYP3A4
SCHEMBL3188810 0.82 ESR1 (0.41) ALDH1A1ESR1ESR2CYP3A4TSHR
SCHEMBL17355647 0.82
SCHEMBL21304588 0.82 TSHR (0.42) MAPK1MAPTKMT2ACYP2C19HIF1A
SCHEMBL11025243 0.82 KIF11 (0.38)
SCHEMBL2068288 0.82 MAPK1 (0.39) MAPK1MAPTKMT2ACYP2C19HIF1A
SCHEMBL18091134 0.82 MAPK1 (0.39) MAPK1MAPTKMT2ACYP2C19HIF1A
SCHEMBL15942798 0.80 TSHR (0.46) MAPTALDH1A1HDAC1HDAC6CYP3A4

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 3061 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119306895-A Polyurethane and polyvinylidene fluoride hybrid emulsion and preparation method thereof 上海交通大学内蒙古研究院 2025-01-14 CN claimed
CN-118290688-A Polyurethane polymer containing oxazolidone structure and composite material thereof 万华化学(北京)有限公司 2024-07-05 CN claimed
CN-114478934-B Polymer polyol preparation method and system thereof and obtained polymer polyol 中国石油化工股份有限公司 2024-06-28 CN claimed
CN-117946528-B Polar polypropylene decorative film and preparation method thereof 佛山(华南)新材料研究院 2024-06-25 CN claimed
CN-118222167-A Preparation method of single-component water-based polyurethane coating with hyperbranched structure 郑州大学 2024-06-21 CN claimed
CN-118222080-A PC/ABS alloy material containing carbonate-based compatibilizer and preparation method thereof 万敬新材料(上海)有限公司 2024-06-21 CN claimed
CN-118206755-A Self-healing elastic material, preparation method thereof and electronic equipment 中国科学技术大学 2024-06-18 CN claimed
CN-118063953-A Preparation method of high-elasticity modified polyurethane material 山西宇德新材料科技有限公司 2024-05-24 CN claimed
CN-117946528-A Polar polypropylene decorative film and preparation method thereof 佛山(华南)新材料研究院 2024-04-30 CN claimed
CN-117924613-A Flexible substrate material and preparation method thereof 中国科学院合肥物质科学研究院 2024-04-26 CN claimed
EP-0385457-A2 High surface hardness transparent resin and polymerizable monomer MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-09-05 EP claimed
EP-0385456-A2 High surface hardness transparent resin and polymerizable monomer MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-09-05 EP claimed
EP-0130322-B1 EMULSION COPOLYMERISATION OF META- OR PARA-ISOPROPENYL-ALPHA,ALPHA-DIMETHYLBENZYLISOCYANATE AMERICAN CYANAMID COMPANY (US) 1990-03-21 EP claimed
EP-0351534-A2 Polyfunctional monomers and process for production thereof MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-01-24 EP claimed
EP-0342205-A1 HARDENABLE COMPOSITION ON THE BASIS OF A MICHAEL ADDITION PRODUCT, PROCESS FOR THE MANUFACTURE THEREOF AND USE THEREOF BASF Lacke + Farben AG (DE) 1989-11-23 EP claimed
WO-1988007556-A1 HARDENABLE COMPOSITION ON THE BASIS OF A MICHAEL ADDITION PRODUCT, PROCESS FOR THE MANUFACTURE THEREOF AND USE THEREOF BASF LACKE + FARBEN AKTIENGESELLSCHAFT (DE) 1988-10-06 WO claimed
US-4754011-A FREE RADICAL CATALYSIS, CHAIN TRANSFER, ADDITION POLYMERIZATION AMERICAN CYANAMID COMPANY (US) 1988-06-28 US claimed
EP-0149038-A2 Cationic copolymerization of meta- or paraisopropenyl-alpha,alpha-dimethylbenzylisocyanate AMERICAN CYANAMID COMPANY (US) 1985-07-24 EP claimed
EP-0130322-A2 Emulsion copolymerisation of meta- or para-isopropenyl-alpha,alpha-dimethylbenzylisocyanate AMERICAN CYANAMID COMPANY (US) 1985-01-09 EP claimed
US-4130577-A FROM THE HALIDE AND AN ALKALI METAL CYANATE SHOWA DENKO K.K. (JP) 1978-12-19 US claimed