SCHEMBL3382832

SCHEMBL3382832

O=C(O)c1coc(CN2CCCCC2)n1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.61
L3MBTL1 Q9Y468 1/20 0.46
ELANE P08246 2/20 0.44
GSK3B P49841 2/20 0.41
CACNA1G O43497 5/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
HIF1A Q16665 1/20 0.40
KCNH2 Q12809 2/20 0.39
RAB9A P51151 2/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
P2RY2 P41231 1/20 0.38
NPC1 O15118 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL7424821 0.98 HRH3 (0.59) HRH3L3MBTL1ELANEGSK3BCACNA1G
SCHEMBL7424959 0.97 HRH3 (0.57) HRH3L3MBTL1ELANEGSK3BCACNA1G
SCHEMBL3384305 0.86 HRH3 (0.62) HRH3GSK3BCACNA1GCYP2C9KCNH2
Potassium Ion SCHEMBL7427991 0.83 HRH3 (0.56) HRH3L3MBTL1ELANEGSK3BCACNA1G
Potassium Ion SCHEMBL7424963 0.83 HRH3 (0.56) HRH3L3MBTL1ELANEGSK3BCACNA1G
SCHEMBL7421852 0.82 HRH3 (0.59) HRH3ELANEGSK3BCACNA1GKCNH2
SCHEMBL7427115 0.81 HRH3 (0.57) HRH3ELANEGSK3BCACNA1GKCNH2
SCHEMBL3387830 0.80 HRH3 (0.57) HRH3ELANECACNA1GKCNH2RAB9A
SCHEMBL7425000 0.80 DRD4 (0.51) HRH3CACNA1GKMT2ASMN1; SMN2
SCHEMBL12965742 0.80 GSK3B (0.48) HRH3ELANEGSK3BCACNA1GKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200231569-A1 3-(1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE DERIVATIVES AND USES THEREOF NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2020-07-23 US disclosed
EP-1771432-B1 NON-IMIDAZOLE HETEROCYCLIC COMPOUNDS AS HISTAMINE H3 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2010-12-08 EP disclosed
US-20080317671-A1 NON-IMIDAZOLE HETEROCYCLIC COMPOUNDS CARRUTHERS NICHOLAS I 2008-12-25 US disclosed
US-7429659-B2 Furan compounds as histamine H3 modulators JANSSEN PHARMACEUTICA N.V. (BE) 2008-09-30 US disclosed
EP-1771432-A2 NON-IMIDAZOLE HETEROCYCLIC COMPOUNDS AS HISTAMINE H3 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2007-04-11 EP disclosed
WO-2005096734-A2 NON-IMIDAZOLE HETEROCYCLIC COMPOUNDS AS HISTAMINE H3 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2005-10-20 WO disclosed
US-20050222129-A1 Non-imidazole heterocyclic compounds JANSSEN PHARMACEUTICAL, N.V. (BE) 2005-10-06 US disclosed
CN-1278820-A Pyrrolopyrrolone derivatives as inhibitors of neutrophil elastase GLAXO GROUP LTD (GB) 2001-01-03 CN disclosed
EP-1003748-A2 PYRROLOPYRROLONE DERIVATIVES AS INHIBITORS OF NEUTROPHIL ELASTASE GLAXO GROUP LIMITED (GB) 2000-05-31 EP disclosed
WO-1999012933-A2 PYRROLOPYRROLONE DERIVATIVES AS INHIBITORS OF NEUTROPHIL ELASTASE GLAXO GROUP LIMITED (GB) 1999-03-18 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 (3 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-20050222129-A1 Non-imidazole heterocyclic compounds HRH3, HRH4, HRH2 HRH3 1/4885L3MBTL1 2056/4885ELANE 1752/4885
US-20080317671-A1 NON-IMIDAZOLE HETEROCYCLIC COMPOUNDS HRH3, HRH4, HRH2 HRH3 1/4885L3MBTL1 2056/4885ELANE 1752/4885
US-20200231569-A1 3-(1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE DERIVATIVES AND USES THEREOF XDH, H1-0, RXFP1 HRH3 564/4885L3MBTL1 4379/4885ELANE 3010/4885

“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.