SCHEMBL432841

SCHEMBL432841

COc1cc(C=CC(=O)Cl)ccc1OOC(C)=O

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
JUN P05412 1/20 0.58
NFKB1 P19838 1/20 0.58
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
HPGD P15428 1/20 0.56
ALOX15 P16050 1/20 0.56
MAPK1 P28482 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HSD17B10 Q99714 1/20 0.56
NFE2L2 Q16236 1/20 0.55
KMT2A Q03164 2/20 0.54
ABCG2 Q9UNQ0 2/20 0.54
MEN1 O00255 1/20 0.54
FDPS P14324 2/20 0.53
APP P05067 3/20 0.52
TOP2A P11388 1/20 0.49
TNFRSF1A P19438 1/20 0.49
PTGES O14684 1/20 0.48

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
SCHEMBL28100185 0.93 NFKB1 (0.48) JUNNFKB1KDM4EALDH1A1HPGD
SCHEMBL8937934 0.87 KDM4E (0.75) JUNNFKB1KDM4EALDH1A1HPGD
SCHEMBL29503043 0.87 KDM4E (0.73) JUNNFKB1KDM4EALDH1A1HPGD
SCHEMBL1589619 0.87 KDM4E (0.73) JUNNFKB1KDM4EALDH1A1HPGD
SCHEMBL1589618 0.87 KDM4E (0.73) JUNNFKB1KDM4EALDH1A1HPGD
Hydrochloric Acid SCHEMBL8937884 0.86 KDM4E (0.73) JUNNFKB1KDM4EALDH1A1HPGD
SCHEMBL4128281 0.86 JUN (0.78) JUNNFKB1KDM4EALDH1A1HPGD
SCHEMBL4121496 0.86 JUN (0.78) JUNNFKB1KDM4EALDH1A1HPGD
SCHEMBL9553292 0.81 ALDH1A1 (0.66) JUNNFKB1KDM4EALDH1A1HPGD
SCHEMBL16670596 0.81 NFE2L2 (0.51) JUNNFKB1KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11326178-B2 P-coumaroyl-CoA:monolignol transferase WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2022-05-10 US disclosed
US-10428342-B2 P-coumaroyl-CoA:monolignol transferase BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2019-10-01 US disclosed
EP-3138919-B1 FERULOYL-COA:MONOLIGNOL-TRANSFERASE UNIV MICHIGAN STATE (US) 2018-12-19 EP disclosed
US-10059955-B2 Hibiscus cannabinus feruloyl-CoA:monolignol transferase BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2018-08-28 US disclosed
EP-2764096-B1 HIBISCUS CANNABINUS FERULOYL-COA:MONOLIGNOL TRANSFERASE UNIV MICHIGAN STATE (US) 2018-04-04 EP disclosed
US-20170218004-A1 FERULOYL-CoA:MONOLIGNOL TRANSFERASE BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2017-08-03 US disclosed
US-20170096675-A1 HIBISCUS CANNABINUS FERULOYL-COA:MONOLIGNOL TRANSFERASE UNITED STATES DEPARTMENT OF ENERGY 2017-04-06 US disclosed
EP-3138919-A1 FERULOYL-CoA:MONOLIGNOL-TRANSFERASE Board of Trustees of Michigan State University (US) 2017-03-08 EP disclosed
EP-2596103-B1 FERULOYL-CoA:MONOLIGNOL TRANSFERASE UNIV MICHIGAN STATE (US) 2016-12-21 EP disclosed
US-9493783-B2 Hibiscus cannabinus feruloyl-coa:monolignol transferase BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2016-11-15 US disclosed
US-20160046955-A1 p-Coumaroyl-CoA:Monolignol Transferase BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2016-02-18 US disclosed
EP-2764096-A1 HIBISCUS CANNABINUS FERULOYL-COA:MONOLIGNOL TRANSFERASE Board Of Trustees Of Michigan State University (US) 2014-08-13 EP disclosed
US-20130219547-A1 FERULOYL-CoA:MONOLIGNOL TRANSFERASE BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2013-08-22 US disclosed
US-20130203973-A1 FERULOYL-CoA:MONOLIGNOL TRANSFERASE ENERGY, UNITED STATES DEPARTMENT OF 2013-08-08 US disclosed
WO-2013090814-A2 p-Coumaroyl-CoA:Monolignol Transferase BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2013-06-20 WO disclosed
EP-2596104-A1 FERULOYL-CoA:MONOLIGNOL TRANSFERASE Board Of Trustees Of Michigan State University (US) 2013-05-29 EP disclosed
EP-2596103-A1 FERULOYL-CoA:MONOLIGNOL TRANSFERASE Board Of Trustees Of Michigan State University (US) 2013-05-29 EP disclosed
WO-2013052660-A1 HIBISCUS CANNABINUS FERULOYL-COA:MONOLIGNOL TRANSFERASE BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2013-04-11 WO disclosed
WO-2012012741-A1 FERULOYL-CoA:MONOLIGNOL TRANSFERASE BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2012-01-26 WO disclosed
WO-2012012698-A1 FERULOYL-CoA:MONOLIGNOL TRANSFERASE BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2012-01-26 WO 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-20130203973-A1 FERULOYL-CoA:MONOLIGNOL TRANSFERASE COASY, FDFT1, FER JUN 2095/4885NFKB1 2470/4885KDM4E 1814/4885
US-20170218004-A1 FERULOYL-CoA:MONOLIGNOL TRANSFERASE COASY, FDFT1, FER JUN 2095/4885NFKB1 2470/4885KDM4E 1814/4885

“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.