SCHEMBL28400877

SCHEMBL28400877

C=CC(=O)NC(CCC)(C(C)(C)C)S(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
ALDH1A1 P00352 3/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL29192529 0.80 ZDHHC20 (0.40) ZDHHC20ZDHHC2ALDH1A1CYP3A4CYP2C9
SCHEMBL722292 0.78 ZDHHC20 (0.41) ZDHHC20ZDHHC2ALDH1A1CYP3A4CYP2C9
SCHEMBL28967290 0.77 ALDH1A1 (0.32) ALDH1A1
SCHEMBL11124078 0.74 ZDHHC20 (0.45) ZDHHC20ZDHHC2ALDH1A1CYP3A4CYP2C9
SCHEMBL2558765 0.74 ZDHHC20 (0.38) ZDHHC20ZDHHC2ALDH1A1CYP3A4CYP2C9
SCHEMBL4906709 0.73 KMT2A (0.53) ZDHHC20ZDHHC2ALDH1A1CYP3A4CYP2C9
SCHEMBL9398270 0.73 ALDH1A1 (0.42) ZDHHC20ZDHHC2ALDH1A1CYP3A4CYP2C9
SCHEMBL16585339 0.73 ZDHHC20 (0.47) ZDHHC20ZDHHC2ALDH1A1CYP3A4CYP2C9
SCHEMBL2724739 0.73 ALDH1A1 (0.38) ZDHHC20ZDHHC2ALDH1A1CYP3A4CYP2C9
SCHEMBL234712 0.73 ALDH1A1 (0.39) ZDHHC20ZDHHC2ALDH1A1CYP3A4CYP2C9

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113164346-B Composition for keratin fibres comprising a direct dye 莱雅公司 2024-04-16 CN disclosed
CN-115485254-B Mixtures comprising superabsorbents 瓦克化学股份公司 2023-12-19 CN disclosed
CN-117120027-A Hair coloring composition comprising at least one (poly) carbodiimide compound and at least one non-carboxylic acid anionic thickener 欧莱雅 2023-11-24 CN disclosed
CN-117015369-A Method for coloring hair keratin fibers comprising the application of a composition comprising at least one (poly) carbodiimide compound and a composition comprising at least one associative polymer and a specific compound 欧莱雅 2023-11-07 CN disclosed
CN-116997320-A Hair colouring composition comprising at least one (poly) carbodiimide compound and at least one compound comprising at least one hydroxyl function 欧莱雅 2023-11-03 CN disclosed
CN-116847820-A Method for removing the color of pre-colored hair keratin fibers 欧莱雅 2023-10-03 CN disclosed
CN-116368106-A Additive for concrete 建筑研究和技术有限公司 2023-06-30 CN disclosed
CN-113194722-B Antimicrobial mixtures containing 4- (3-ethoxy-4-hydroxyphenyl) butan-2-one and 4-hydroxyacetophenone, and compositions containing the same 莱雅公司 2023-05-05 CN disclosed
CN-115485254-A Mixture comprising superabsorbers 瓦克化学股份公司 2022-12-16 CN disclosed
CN-115461385-A Aqueous polymer dispersions 巴斯夫欧洲公司 2022-12-09 CN disclosed
CN-111032594-A Hybrid foam 巴斯夫欧洲公司 2020-04-17 CN disclosed