SCHEMBL21811482

SCHEMBL21811482

CCCCCCOC(=O)C(I)CCC

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.52
EPHX1 P07099 1/20 0.48
TSHR P16473 3/20 0.47
HCAR2 Q8TDS4 1/20 0.44
RAD52 P43351 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ESR1 P03372 1/20 0.44
AKR1C4 P17516 1/20 0.44
AKR1C3 P42330 1/20 0.44
AKR1C2 P52895 1/20 0.44
AKR1C1 Q04828 1/20 0.44
FAAH O00519 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
ACHE P22303 6/20 0.43

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
SCHEMBL21811520 1.00 NAAA (0.52) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL21811669 1.00 NAAA (0.52) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL21811481 1.00 NAAA (0.52) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL21811516 1.00 NAAA (0.52) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL21811449 1.00 NAAA (0.52) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL21811608 0.98 NAAA (0.48) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL21811494 0.92 ALDH1A1 (0.50) NAAAEPHX1TSHRHCAR2ESR1
SCHEMBL7066889 0.89 NAAA (0.48) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL7971345 0.89 NAAA (0.48) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL8027706 0.89 NAAA (0.47) NAAAEPHX1TSHRHCAR2RAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11958802-B2 Migration-resistant photopolymerization sensitizer KAWASAKI KASEI CHEMICALS LTD. (JP) 2024-04-16 US disclosed
US-20220106254-A1 MIGRATION-RESISTANT PHOTOPOLYMERIZATION SENSITIZER KAWASAKI KASEI CHEMICALS LTD. (JP) 2022-04-07 US disclosed
CN-113166036-A Photopolymerisable sensitizers having migration resistance 川崎化成工业株式会社 2021-07-23 CN disclosed
WO-2020213442-A1 PHOTOPOLYMERIZABLE COMPOSITION, COATING FILM CONTAINING SAID PHOTOPOLYMERIZABLE COMPOSITION, AND CURING METHOD THEREFOR 川崎化成工業株式会社 2020-10-22 WO disclosed
WO-2020208833-A1 PHOTO-RADICALLY CURABLE OXYGEN-INHIBITION-REDUCING AGENT, PHOTO-RADICALLY CURABLE OXYGEN-INHIBITION-REDUCING AGENT-CONTAINING PHOTO-RADICALLY POLYMERIZABLE COMPOSITION, PHOTO-RADICALLY CURABLE OXYGEN-INHIBITION-REDUCING AGENT-CONTAINING COATING FILM, AND METHOD FOR CURING SAME 川崎化成工業株式会社 2020-10-15 WO disclosed
WO-2020209209-A1 RADICAL PHOTOCURING OXYGEN INHIBITION REDUCER, RADICAL PHOTOPOLYMERIZABLE COMPOSITION CONTAINING RADICAL PHOTOCURING OXYGEN INHIBITION REDUCER, COATING CONTAINING RADICAL PHOTOCURING OXYGEN INHIBITION REDUCER, AND METHOD FOR CURING SAME 川崎化成工業株式会社 2020-10-15 WO disclosed
WO-2020121384-A1 PHOTOPOLYMERIZATION SENSITIZER HAVING MIGRATION RESISTANCE 川崎化成工業株式会社 2020-06-18 WO disclosed
WO-2020054116-A1 PHOTOPOLYMERIZATION SENSITIZER 川崎化成工業株式会社 2020-03-19 WO disclosed
WO-2020054874-A1 PHOTOPOLYMERIZATION SENSITIZER 川崎化成工業株式会社 2020-03-19 WO disclosed
CN-110003432-A A kind of preparation method of fluorochemical urethane 苏州大学 2019-07-12 CN disclosed
CN-106832194-B A kind of textile water repellent finish liquid and the preparation method and application thereof based on fluorochemical urethane 南通纺织丝绸产业技术研究院 2019-07-09 CN disclosed
CN-106750125-B Fluorine-containing polyurethane and preparation method and application thereof 苏州大学 2019-05-28 CN disclosed
CN-106750236-B Fluorine-containing alkyl copolyether and preparation method thereof 苏州大学 2019-01-11 CN disclosed
CN-108707227-A A kind of preparation method of the copolyether containing fluoroalkyl 苏州大学 2018-10-26 CN disclosed
CN-106832194-A A kind of textile water repellent finish liquid based on fluorochemical urethane and preparation method and application 南通纺织丝绸产业技术研究院 2017-06-13 CN disclosed
CN-106750236-A Fluorine-containing alkyl copolyether and preparation method thereof 苏州大学 2017-05-31 CN disclosed
CN-106750125-A Fluorine-containing polyurethane and preparation method and application thereof 苏州大学 2017-05-31 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11958802-B2 Migration-resistant photopolymerization sensitizer F12, F10, PCNA NAAA 1666/4885EPHX1 1588/4885TSHR 2947/4885
US-20220106254-A1 MIGRATION-RESISTANT PHOTOPOLYMERIZATION SENSITIZER F12, F10, PCNA NAAA 1666/4885EPHX1 1588/4885TSHR 2947/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.