SCHEMBL940422

SCHEMBL940422

CC(=O)OCOC(=O)CCCCO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.42
PRKCA P17252 3/20 0.41
GPR84 Q9NQS5 1/20 0.39
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
PAM P19021 2/20 0.38
KDM4E B2RXH2 2/20 0.38
LMNA P02545 2/20 0.38
DUSP3 P51452 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP1A2 P05177 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 1/20 0.37
TSHR P16473 1/20 0.36
MAPT P10636 1/20 0.36
PRKCE Q02156 1/20 0.36
PRKCQ Q04759 1/20 0.36
PRKCD Q05655 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
SCHEMBL3832870 0.91 DGKA (0.48) DGKAPRKCAPAMKDM4ELMNA
SCHEMBL3834147 0.89 DGKA (0.52) DGKAPRKCAPAMKDM4ELMNA
SCHEMBL11886036 0.86 GPR84 (0.52) DGKAPRKCAGPR84FFAR1FFAR4
SCHEMBL7774212 0.86 GPR84 (0.52) DGKAPRKCAGPR84FFAR1FFAR4
SCHEMBL7534986 0.86 GPR84 (0.52) DGKAPRKCAGPR84FFAR1FFAR4
SCHEMBL8454940 0.86 GPR84 (0.52) DGKAPRKCAGPR84FFAR1FFAR4
SCHEMBL19674961 0.84 TSHR (0.46) DGKAPRKCAPAMLMNACYP1A2
Ethyl Acetate SCHEMBL9280580 0.83 ALDH1A1 (0.56) DGKAPRKCALMNAKMT2ACYP1A2
SCHEMBL3832869 0.83 TSHR (0.50) GPR84FFAR1FFAR4PAMLMNA
SCHEMBL940267 0.83 DGKA (0.42) DGKAPRKCAPAMKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11560365-B2 Non-fluorescent rhodamines THE UNIVERSITY OF TOKYO (JP) 2023-01-24 US disclosed
US-20210087160-A1 NOVEL NON-FLUORESCENT RHODAMINES THE UNIVERSITY OF TOKYO (JP) 2021-03-25 US disclosed
US-20210072241-A1 FLUORESCENT PROBE FOR DETECTING CARBOXYPEPTIDASE ACTIVITY THE UNIVERSITY OF TOKYO (JP) 2021-03-11 US disclosed
US-10815379-B2 pH sensitive fluorescent probe THE UNIVERSITY OF TOKYO (JP) 2020-10-27 US disclosed
EP-3636653-A1 ASYMMETRICAL SI RHODAMINE AND RHODOL SYNTHESIS The University of Tokyo (JP) 2020-04-15 EP disclosed
US-10004815-B2 Near-infrared quenching group THE UNIVERSITY OF TOKYO (JP) 2018-06-26 US disclosed
US-20180118943-A1 PH SENSITIVE FLUORESCENT PROBE THE UNIVERSITY OF TOKYO (JP) 2018-05-03 US disclosed
US-20180052105-A1 SULFANE SULFUR-SELECTIVE FLUORESCENT PROBE THE UNIVERSITY OF TOKYO (JP) 2018-02-22 US disclosed
US-9714260-B2 Asymmetrical Si rhodamine and rhodol synthesis THE UNIVERSITY OF TOKYO (JP) 2017-07-25 US disclosed
US-9688857-B2 Fluorescent probe THE UNIVERSITY OF TOKYO (JP) 2017-06-27 US disclosed
US-20150353585-A1 ASYMMETRICAL SI RHODAMINE AND RHODOL SYNTHESIS THE UNIVERSITY OF TOKYO (JP) 2015-12-10 US disclosed
US-9187499-B2 Fluorescent probe THE UNIVERSITY OF TOKYO (JP) 2015-11-17 US disclosed
EP-2942352-A1 ASYMMETRICAL Si RHODAMINE AND RHODOL SYNTHESIS The University of Tokyo (JP) 2015-11-11 EP disclosed
US-9170266-B2 Fluorescent probe THE UNIVERSITY OF TOKYO (JP) 2015-10-27 US disclosed
US-20150212073-A1 FLUORESCENT PROBE THE UNIVERSITY OF TOKYO (JP) 2015-07-30 US disclosed
US-20140057312-A1 FLUORESCENT PROBE THE UNIVERSITY OF TOKYO (JP) 2014-02-27 US disclosed
US-20130289256-A1 FLUORESCENT PROBE THE UNIVERSITY OF TOKYO (JP) 2013-10-31 US disclosed
US-7868147-B2 substantially no fluorescent before the cleavage but highly fluorescent after the cleavage; traps a target substance such as an enzyme and emits fluorescence Nagano, Tetsuo (JP) 2011-01-11 US disclosed
US-20080014602-A1 Fluorescent Probe SEKISUI MEDICAL CO., LTD. (JP) 2008-01-17 US disclosed
EP-1674579-A1 FLUORESCENT PROBE DAIICHI PURE CHEMICALS CO., LTD. (JP) 2006-06-28 EP 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 (8 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-20210087160-A1 NOVEL NON-FLUORESCENT RHODAMINES QTRT1, QTRT2, NONO DGKA 2189/4885PRKCA 4494/4885GPR84 628/4885
US-20150353585-A1 ASYMMETRICAL SI RHODAMINE AND RHODOL SYNTHESIS RER1, SRR, SQLE DGKA 2313/4885PRKCA 4214/4885GPR84 2883/4885
US-20150212073-A1 FLUORESCENT PROBE SSTR3, SSTR1, SSTR5 DGKA 3857/4885PRKCA 4615/4885GPR84 228/4885
US-10815379-B2 pH sensitive fluorescent probe PHF6, PHF8, NHERF1 DGKA 1497/4885PRKCA 1914/4885GPR84 3542/4885
US-20210072241-A1 FLUORESCENT PROBE FOR DETECTING CARBOXYPEPTIDASE ACTIVITY CPN1, DNPEP, ANPEP DGKA 4384/4885PRKCA 3216/4885GPR84 1910/4885
US-10004815-B2 Near-infrared quenching group CRY2, RELA, CRY1 DGKA 2974/4885PRKCA 4012/4885GPR84 3980/4885
US-11560365-B2 Non-fluorescent rhodamines QTRT1, QTRT2, NONO DGKA 2016/4885PRKCA 4503/4885GPR84 639/4885
US-20130289256-A1 FLUORESCENT PROBE HNRNPH3, H1-3, REL DGKA 783/4885PRKCA 4164/4885GPR84 623/4885

“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.