SCHEMBL2172604

SCHEMBL2172604

O=C(O)CCN(C(=O)CBr)N1C(=O)CCC1=O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
KDM5A P29375 1/20 0.31
ALDH1A1 P00352 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL3392049 0.83 KDM4E (0.34) KDM4EGAAHTT
SCHEMBL31419341 0.73 BLM (0.33)
SCHEMBL15513698 0.72 DRD2 (0.33) ALDH1A1PKM
SCHEMBL6890746 0.72 LMNA (0.35) GAAKDM5A
SCHEMBL16908564 0.67 KDM4E (0.32) KDM4EGAAHTTALDH1A1
SCHEMBL17232580 0.65 TSHR (0.43) KDM4EKDM5A
Bromoacetic Acid SCHEMBL1064789 0.64 TSHR (0.48) ALDH1A1PKM
SCHEMBL1769618 0.63 HTT (0.37) KDM4EGAAHTTALDH1A1
SCHEMBL16908561 0.62 KDM4E (0.33) KDM4EGAAHTT
SCHEMBL6738514 0.62 LMNA (0.39) GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2437790-B1 CONJUGATION METHODS IMMUNOGEN INC (US) 2019-02-20 EP claimed
US-20230045939-A1 STABLE VACCINE AGAINST CLOSTRIDIUM DIFFICILE IDORSIA PHARMACEUTICALS LTD (CH) 2023-02-16 US disclosed
EP-3883944-A1 STABLE VACCINE AGAINST CLOSTRIDIUM DIFFICILE Idorsia Pharmaceuticals Ltd (CH) 2021-09-29 EP disclosed
US-10723731-B2 Heterobifunctional linkers with polyethylene glycol segments and immune response modifier conjugates made therefrom 3M INNOVATIVE PROPERTIES COMPANY (US) 2020-07-28 US disclosed
US-10328141-B2 Synthetic vaccines against Streptococcus pneumoniae type 1 MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2019-06-25 US disclosed
US-20180186792-A1 HETEROBIFUNCTIONAL LINKERS WITH POLYETHYLENE GLYCOL SEGMENTS AND IMMUNE RESPONSE MODIFIER CONJUGATES MADE THEREFROM 3M INNOVATIVE PROPERTIES COMPANY 2018-07-05 US disclosed
US-9902724-B2 Heterobifunctional linkers with polyethylene glycol segments and immune response modifier conjugates made therefrom 3M INNOVATIVE PROPERTIES COMPANY (US) 2018-02-27 US disclosed
EP-3019513-B1 SYNTHETIC VACCINES AGAINST STREPTOCOCCUS PNEUMONIAE TYPE 1 MAX-PLANCK-GESELLSCHAFT ZUR FÖRDERUNG DER WSS E V (DE) 2018-01-17 EP disclosed
WO-2017189448-A1 BIVALENT IMMUNOGENIC CONJUGATE FOR MALARIA AND TYPHOID THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2017-11-02 WO disclosed
EP-3153180-A1 HETEROBIFUNCTIONAL LINKERS WITH POLYETHYLENE GLYCOL SEGMENTS AND IMMUNE RESPONSE MODIFIER CONJUGATES MADE THEREFROM 3M Innovative Properties Company (US) 2017-04-12 EP disclosed
EP-2086577-B1 CONJUGATES OF THE PLASMODIUM FALCIPARUM SURFACE PROTEIN PFS25 AS MALARIA VACCINE US GOV HEALTH & HUMAN SERV (US) 2013-03-27 EP disclosed
US-8383133-B2 Conjugates of Plasmodium falciparum surface proteins as malaria vaccines THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2013-02-26 US disclosed
WO-2012167088-A1 HETEROBIFUNCTIONAL LINKERS WITH POLYETHYLENE GLYCOL SEGMENTS AND IMMUNE RESPONSE MODIFIER CONJUGATES MADE THEREFROM 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-12-06 WO disclosed
US-20110182929-A1 MULTICOMPONENT VACCINE FOR MALARIA PROVIDING LONG-LASTING IMMUNE RESPONSES AGAINST PLASMODIA NEW YORK UNIVERSITY 2011-07-28 US disclosed
EP-2346523-A2 A MULTICOMPONENT VACCINE FOR MALARIA PROVIDING LONG-LASTING IMMUNE RESPONSES AGAINST PLASMODIA The United States Of America,As Represented By The Secretary, Department Of Health And Human Services (US) 2011-07-27 EP disclosed
US-20100183678-A1 CONJUGATES OF PLASMODIUM FALCIPARUM SURFACE PROTEINS AS MALARIA VACCINES The Govenment of the United States of America as represented by tge Secreatary of Health (US) 2010-07-22 US disclosed
WO-2010040000-A2 A MULTICOMPONENT VACCINE FOR MALARIA PROVIDING LONG-LASTING IMMUNE RESPONSES AGAINST PLASMODIA THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES (US) 2010-04-08 WO disclosed
CN-101557821-A Conjugates of plasmodium falciparum surface proteins as malaria vaccines US GOVERNMENT (US) 2009-10-14 CN disclosed
EP-2086577-A2 CONJUGATES OF PLASMODIUM FALCIPARUM SURFACE PROTEINS AS MALARIA VACCINES The Government of the United States of America as represented by the Secretary of the Department of Health and Human Services (US) 2009-08-12 EP disclosed
WO-2008048945-A2 CONJUGATES OF PLASMODIUM FALCIPARUM SURFACE PROTEINS AS MALARIA VACCINES THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2008-04-24 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 (6 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-10723731-B2 Heterobifunctional linkers with polyethylene glycol segments and immune response modifier conjugates made therefrom IL2, ICOS, CD40 KDM4E 3892/4885GAA 3064/4885HTT 4757/4885
US-20230045939-A1 STABLE VACCINE AGAINST CLOSTRIDIUM DIFFICILE DDOST, SI, CD4 KDM4E 2876/4885GAA 1233/4885HTT 4630/4885
US-20110182929-A1 MULTICOMPONENT VACCINE FOR MALARIA PROVIDING LONG-LASTING IMMUNE RESPONSES AGAINST PLASMODIA CD47, NASP, CD69 KDM4E 4228/4885GAA 3592/4885HTT 4620/4885
US-20180186792-A1 HETEROBIFUNCTIONAL LINKERS WITH POLYETHYLENE GLYCOL SEGMENTS AND IMMUNE RESPONSE MODIFIER CONJUGATES MADE THEREFROM IL2, ICOS, CD40 KDM4E 3892/4885GAA 3064/4885HTT 4757/4885
US-20100183678-A1 CONJUGATES OF PLASMODIUM FALCIPARUM SURFACE PROTEINS AS MALARIA VACCINES CD4, RPS25, OSBP2 KDM4E 4237/4885GAA 4186/4885HTT 3900/4885
US-10328141-B2 Synthetic vaccines against Streptococcus pneumoniae type 1 NEU1, ALG1, CSGALNACT1 KDM4E 2231/4885GAA 625/4885HTT 2169/4885

“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.