SCHEMBL28334151

SCHEMBL28334151

CCCCCCCCCCCCCCCCCC(=O)C(CN(C)CCO)C(=O)CCCCCCCCCCCCCCCCC.COS(=O)(=O)O

nearest known ligand 0.37

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.37
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
KDM5A P29375 1/20 0.36
GGPS1 O95749 3/20 0.35
DNM1 Q05193 1/20 0.35
POLB P06746 1/20 0.35
POLA1 P09884 1/20 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
SCHEMBL5940755 1.00 CES2 (0.37) CES2THRATHRBKDM5AGGPS1
SCHEMBL28339296 0.95 CES2 (0.36) CES2THRATHRBKDM5AGGPS1
SCHEMBL28405188 0.93 CNR1 (0.45) POLB
Sulfuric Acid SCHEMBL28412565 0.92 CES2 (0.41) CES2THRATHRBGGPS1DNM1
Sulfuric Acid SCHEMBL28748105 0.92 CES2 (0.41) CES2THRATHRBGGPS1DNM1
SCHEMBL457736 0.89 CES2 (0.46) CES2THRATHRBGGPS1DNM1
SCHEMBL457767 0.89 CES2 (0.46) CES2THRATHRBGGPS1DNM1
Hydrochloric Acid SCHEMBL17294135 0.87 CES2 (0.44) CES2THRATHRBGGPS1DNM1
SCHEMBL28532295 0.85 CES2 (0.42) CES2DNM1POLBPOLA1
Sulfuric Acid SCHEMBL28836708 0.85 CNR1 (0.49) POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106170319-B Compositions and dispersions comprising polymer-containing particles 欧莱雅 2019-12-24 CN claimed
CN-115243663-A Composition for caring for keratin materials and use thereof 莱雅公司 2022-10-25 CN disclosed
CN-114901249-A Composition for conditioning keratin materials 莱雅公司 2022-08-12 CN disclosed
CN-114828814-A Composition for conditioning keratin materials 莱雅公司 2022-07-29 CN disclosed
CN-114514012-A External preparation for skin 株式会社高丝 2022-05-17 CN disclosed
CN-113490513-A Biological material 富士胶片株式会社 2021-10-08 CN disclosed
CN-107412005-B Composition for dyeing keratin fibers 莱雅公司 2021-10-01 CN disclosed
CN-107847415-B Composition for treating keratin fibers 莱雅公司 2021-09-07 CN disclosed
CN-107750153-B Compositions and methods for treating hair 欧莱雅 2021-09-03 CN disclosed
CN-113164345-A Cosmetic composition comprising a specific hyperbranched copolymer and an oil 帝斯曼知识产权资产管理有限公司 2021-07-23 CN disclosed
CN-113164795-A Cosmetic composition comprising a dispersion of a specific hyperbranched copolymer and an acrylic polymer 帝斯曼知识产权资产管理有限公司 2021-07-23 CN disclosed
CN-113164796-A Cosmetic composition comprising a specific hyperbranched copolymer and an anionic emulsifier 帝斯曼知识产权资产管理有限公司 2021-07-23 CN disclosed
CN-113164373-A Cosmetic composition comprising a specific hyperbranched copolymer and an organic UV filter 帝斯曼知识产权资产管理有限公司 2021-07-23 CN disclosed
CN-113164359-A Cosmetic composition comprising a specific hyperbranched copolymer and a nonionic emulsifier which is an ether or ester of a (poly) ethylene oxide 帝斯曼知识产权资产管理有限公司 2021-07-23 CN disclosed
CN-112616848-A Enhanced preservatives 奥麒化工股份有限公司 2021-04-09 CN disclosed
CN-112566613-A Mixed quaternary ammonium salts, especially in hair treatment compositions 赢创运营有限公司 2021-03-26 CN disclosed
CN-112469389-A Amine-based reaction products as functional additives 汉高股份有限及两合公司 2021-03-09 CN disclosed
CN-105377224-B Dyeing composition 莱雅公司 2021-02-12 CN disclosed