SCHEMBL27609883

SCHEMBL27609883

CCOC(=O)C(C)=CCCN(C(C)C)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.47
CYP2C19 P33261 1/20 0.47
GLO1 Q04760 1/20 0.38
NPSR1 Q6W5P4 2/20 0.34
ALDH1A1 P00352 5/20 0.33
LMNA P02545 2/20 0.33
HSD17B10 Q99714 1/20 0.33
CYP2C9 P11712 1/20 0.33
MAPT P10636 2/20 0.32
GAA P10253 1/20 0.32
FAAH O00519 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
S1PR4 O95977 1/20 0.31
S1PR1 P21453 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TSHR P16473 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM1 P11229 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
SCHEMBL27535561 0.87 CYP2D6 (0.36) CYP2D6CYP2C19TSHRCHRM2CHRM1
SCHEMBL28808739 0.83 MAPT (0.33) CYP2D6CYP2C19ALDH1A1MAPTMEN1
SCHEMBL29138969 0.81 TSHR (0.45) CYP2D6CYP2C19ALDH1A1TSHRCHRM2
SCHEMBL808675 0.81 CYP2D6 (0.47) CYP2D6CYP2C19GLO1NPSR1ALDH1A1
SCHEMBL27941950 0.80 CHRM2 (0.37) CYP2D6CYP2C19CHRM2CHRM1CHRM3
SCHEMBL28646355 0.79 CYP2D6 (0.46) CYP2D6CYP2C19GLO1NPSR1ALDH1A1
SCHEMBL11617504 0.77 CYP2D6 (0.57) CYP2D6CYP2C19GLO1NPSR1ALDH1A1
SCHEMBL488996 0.77 CD81 (0.35) MEN1KMT2ACHRM2CHRM1CHRM3
SCHEMBL2560475 0.77 CD81 (0.35) MEN1KMT2ACHRM2CHRM1CHRM3
SCHEMBL27467602 0.77 CHRM2 (0.39) CYP2D6CYP2C19CHRM2CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110177870-A Thermo-responsive micro-carrier system and application thereof 新加坡科技研究局 2019-08-27 CN claimed
CN-106188555-B A kind of tumour intelligently targeting and environment double responsiveness siRNA delivery system and preparation method and application 中山大学 2019-02-05 CN claimed
CN-108822267-A preparation and application of pH-responsive protein macromolecule amphiphile 清华大学 2018-11-16 CN claimed
CN-105669924-B The organic inorganic hybridization block copolymer and its synthetic method of the structure containing POSS 厦门大学 2018-08-21 CN claimed
CN-104892815-B Surface positively charged fluorescent nanometer microsphere and its biologic applications with aggregation inducing Fluorescence Increasing property 吉林大学 2018-04-13 CN claimed
CN-104744628-B PH-sensitive irregular copolymer as well as preparation method and application thereof 厦门大学 2017-01-18 CN claimed
CN-106188555-A A kind of tumor intelligence targeting and environment double responsiveness siRNA delivery system and preparation method and application 中山大学 2016-12-07 CN claimed
CN-105669924-A Organic-inorganic linear-dendritic hybrid copolymer containing POSS structure and synthetic method of organic-inorganic linear-dendritic hybrid copolymer 厦门大学 2016-06-15 CN claimed
CN-1577129-A Gel organosol including amphipathic copolymeric binder having crosslinking functionality and liquid toners for electrophotographic applications SAMSUNG ELECTRONICS CO LTD (KR) 2005-02-09 CN claimed
CN-110177870-A Thermo-responsive micro-carrier system and application thereof 新加坡科技研究局 2019-08-27 CN disclosed
CN-109503834-A A kind of preparation method of the quaternized antibacterial agent of long chain alkane and products thereof and application 北京化工大学 2019-03-22 CN disclosed
CN-106188555-B A kind of tumour intelligently targeting and environment double responsiveness siRNA delivery system and preparation method and application 中山大学 2019-02-05 CN disclosed
CN-109232789-A High-performance selfreparing rubber based on polyampholyte and preparation method thereof 四川大学 2019-01-18 CN disclosed
CN-108822267-A preparation and application of pH-responsive protein macromolecule amphiphile 清华大学 2018-11-16 CN disclosed
CN-104744628-B PH-sensitive irregular copolymer as well as preparation method and application thereof 厦门大学 2017-01-18 CN disclosed
CN-106188555-A A kind of tumor intelligence targeting and environment double responsiveness siRNA delivery system and preparation method and application 中山大学 2016-12-07 CN disclosed
CN-105859990-A Polymer with side chains containing lipoyl, preparation method of polymer, polymer vesica prepared from polymer and application of polymer vesica 苏州大学 2016-08-17 CN disclosed
CN-105669924-A Organic-inorganic linear-dendritic hybrid copolymer containing POSS structure and synthetic method of organic-inorganic linear-dendritic hybrid copolymer 厦门大学 2016-06-15 CN disclosed
CN-104936579-A Method for eliciting an immune response to an immunogen AGENCY SCIENCE TECH & RES 2015-09-23 CN disclosed
CN-1577129-A Gel organosol including amphipathic copolymeric binder having crosslinking functionality and liquid toners for electrophotographic applications SAMSUNG ELECTRONICS CO LTD (KR) 2005-02-09 CN disclosed