SCHEMBL28042205

SCHEMBL28042205

CCCCC(CC)CC(=O)ONC(C)=O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.46
TSHR P16473 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
ATM Q13315 1/20 0.46
RECQL P46063 1/20 0.42
CA2 P00918 7/20 0.42
ALDH1A1 P00352 4/20 0.41
CA1 P00915 4/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MMP9 P14780 1/20 0.38
MMP8 P22894 1/20 0.38
MMP14 P50281 1/20 0.38
PLA2G2C Q5R387 1/20 0.36

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
SCHEMBL14022813 0.80 CYP3A4 (0.53) CYP3A4TSHRTDP1ATMRECQL
Ammonia Solution, Strong SCHEMBL28001044 0.79 ALDH1A1 (0.47) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL28326178 0.77 CYP3A4 (0.53) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL8005774 0.75 GPR84 (0.54) PLA2G2C
SCHEMBL2255277 0.75 TSHR (0.47) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL8334750 0.75 CYP3A4 (0.56) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL28005285 0.75 CYP3A4 (0.51) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL2313022 0.75 CYP3A4 (0.51) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL6761797 0.74 ALDH1A1 (0.54) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL10441271 0.74 ZDHHC7 (0.49) CYP3A4TSHRTDP1ATMRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114848518-A Long-acting sunscreen mosquito-repellent emulsion and preparation method thereof 闫朝杰 2022-08-05 CN claimed
CN-112500799-A Automobile wax with mosquito repelling effect and preparation method thereof 韩晓康 2021-03-16 CN claimed
CN-115023138-B Quantitative spray aerosol product for controlling specific harmful substances and method for controlling specific harmful substances using the same 大日本除虫菊株式会社 2024-05-17 CN disclosed
CN-116634992-A Transparent gel 欧荔安股份有限公司 2023-08-22 CN disclosed
CN-115397385-A Oil-in-water emulsion comprising solid lipid material 弗门尼舍有限公司 2022-11-25 CN disclosed
CN-112898176-B 10-undecylenoyl amino ethyl propionate, preparation method thereof and application thereof in mosquito repelling 广东省科学院动物研究所 2022-03-04 CN disclosed
CN-112898176-A 10-undecylenoyl amino ethyl propionate, preparation method thereof and application thereof in mosquito repelling 广东省科学院动物研究所 2021-06-04 CN disclosed
CN-112500799-A Automobile wax with mosquito repelling effect and preparation method thereof 韩晓康 2021-03-16 CN disclosed
CN-110591835-A Insect-expelling and bacteriostatic laundry detergent and preparation method thereof 贵州山水生物科技有限公司 2019-12-20 CN disclosed
CN-109689022-A Low molecular weight keratin hydrolyzate 巴斯夫欧洲公司 2019-04-26 CN disclosed
CN-109689021-A Protein hydrolysate 巴斯夫欧洲公司 2019-04-26 CN disclosed
CN-105451821-A Skin care formulations AKZO NOBEL CHEMICALS INT BV 2016-03-30 CN disclosed