SCHEMBL393486

SCHEMBL393486

CC(C)C(=O)O.CC(C)C(=O)O.CCCC(C)(C)C(C)(O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 2/20 0.34
ADRA1A P35348 2/20 0.34
AKR1A1 P14550 1/20 0.34
CHRM3 P20309 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HRH1 P35367 1/20 0.34
DRD3 P35462 1/20 0.34
SLC6A3 Q01959 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CA2 P00918 1/20 0.34
MAPK1 P28482 1/20 0.34
LCK P06239 1/20 0.32
PPARD Q03181 1/20 0.32
ZDHHC20 Q5W0Z9 1/20 0.32
ZDHHC2 Q9UIJ5 1/20 0.32
FDPS P14324 1/20 0.32
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL201294 1.00 CHRM1 (0.34) CHRM1ADRA1AAKR1A1CHRM3HTR2A
1-Hexanol SCHEMBL2519375 0.86 LMNA (0.42) LCKPPARDZDHHC20ZDHHC2ALDH1A1
Isobutane SCHEMBL4523728 0.84 ALDH1A1 (0.33) FDPSALDH1A1
SCHEMBL93676 0.81 ALDH1A1 (0.39) FDPSALDH1A1LMNAHSD17B10
SCHEMBL5197316 0.78 CHRM1 (0.34) CHRM1ADRA1AAKR1A1CHRM3HTR2A
Butyric Acid SCHEMBL28570191 0.78 FFAR3 (0.56) CHRM1ADRA1AHDAC1HDAC2TDP1
Adipic Acid SCHEMBL8460954 0.77 AKR1B1 (0.54) TDP1PPARDALDH1A1LMNAHSD17B10
Methacrylic Acid SCHEMBL1559791 0.77 TET2 (0.36) CHRM1ADRA1AFDPSALDH1A1LMNA
Propylene Glycol SCHEMBL9343111 0.76 TDP1 (0.46) TDP1MAPK1
SCHEMBL28206327 0.74 CA2 (0.43) CA2MAPK1LCKPPARDZDHHC20

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119907837-A Coating composition having heat insulation property and coated metal sheet using the same 浦项股份有限公司 2025-04-29 CN claimed
CN-119015394-A Sulfur-containing compound preparation, and preparation method and application thereof 上海优斐斯生物科技有限公司 2024-11-26 CN claimed
CN-118067872-A High-flux detection method for 121 plastic additives in oily food 中国农业科学院农产品加工研究所 2024-05-24 CN claimed
CN-118064079-A Antistatic glue solution and application thereof 苏州思展实业有限公司 2024-05-24 CN claimed
CN-116855094-A Asphalt regenerant based on SBR novel process treatment and preparation method thereof 吉林大学 2023-10-10 CN claimed
CN-116745367-A Unconstrained vibration-damping metal plate with foaming holes and manufacturing method thereof 浦项股份有限公司 2023-09-12 CN claimed
CN-116042076-A Low-thermal-resistance quick-setting roadway spraying foaming sealing material and preparation method thereof 南京科工煤炭科学技术研究有限公司 2023-05-02 CN claimed
CN-113004643-B starch/PVA composite antibacterial preservative film and preparation method thereof 浙江农林大学 2022-12-13 CN claimed
CN-114181479-A Preparation method of high-strength high-elongation PVC gloves 英科医疗科技股份有限公司 2022-03-15 CN claimed
CN-113072799-A Water-soluble and degradable high polymer material-based garbage bag and preparation method thereof 浙江农林大学 2021-07-06 CN claimed
CN-113004643-A starch/PVA composite antibacterial preservative film and preparation method thereof 浙江农林大学 2021-06-22 CN claimed
CN-111334106-A Water-resistant salt-resistant anticorrosive paint 江苏科环新材料有限公司 2020-06-26 CN claimed
US-9273217-B2 Composition that can be screen printed onto polyvinyl butyral SAINT-GOBAIN GLASS FRANCE (FR) 2016-03-01 US claimed
US-20150361274-A1 METHOD FOR COATING METALLIC SURFACES WITH A COMPOSITION THAT IS RICH IN POLYMERS CHEMETALL GMBH (DE) 2015-12-17 US claimed
US-9175170-B2 Method for coating metallic surfaces with a composition that is rich in polymers CHEMETALL GMBH (DE) 2015-11-03 US claimed
EP-1599551-B1 METHOD FOR COATING METALLIC SURFACES WITH A COMPOSITION THAT IS RICH IN POLYMERS CHEMETALL GMBH (DE) 2012-05-09 EP claimed
US-20110039115-A1 PROCESS FOR COATING METALLIC SURFACES WITH A SILANE-RICH COMPOSITION DOMES HERIBERT 2011-02-17 US claimed
US-20060127681-A1 Method for coating metallic surfaces with a silane-rich composition CHEMETALL GMBH (DE) 2006-06-15 US claimed
US-20060099429-A1 Method for coating metallic surfaces with a composition that is rich in polymers CHEMETALL GMBH (DE) 2006-05-11 US claimed
US-5443158-A Dispersing surfactant throught the slurry, conditioning slurry by mixing and agitating surface of coal particles to coat with surfactant, dispersing oil, second conditioning, selective floatation in presence of gas bubble, separation from gangue FORDING COAL LIMITED (CA) 1995-08-22 US claimed