SCHEMBL12299591

SCHEMBL12299591

O=C(Nc1ccncc1)c1ccc(CCl)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.73
L3MBTL1 Q9Y468 1/20 0.73
KMT2A Q03164 2/20 0.68
NT5E P21589 1/20 0.68
GAA P10253 1/20 0.62
JAK2 O60674 1/20 0.62
TYK2 P29597 1/20 0.62
POLB P06746 2/20 0.59
STAT3 P40763 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
MAPK1 P28482 1/20 0.58
MEN1 O00255 1/20 0.58
SCD O00767 1/20 0.58
LMNA P02545 2/20 0.57
HTT P42858 1/20 0.57
MAPT P10636 1/20 0.56
ROCK2 O75116 3/20 0.55
ROCK1 Q13464 3/20 0.55
NAMPT P43490 2/20 0.55
HIF1A Q16665 1/20 0.54

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
SCHEMBL7087581 0.93 GAA (0.73) KDM4EL3MBTL1KMT2ANT5EGAA
SCHEMBL2021051 0.88 MEN1 (0.57) KDM4EL3MBTL1KMT2AGAAPOLB
SCHEMBL21674204 0.88 MEN1 (0.57) KDM4EL3MBTL1KMT2AGAAPOLB
SCHEMBL14716526 0.86 KDM4E (1.00) KDM4EL3MBTL1KMT2ANT5EGAA
SCHEMBL12228179 0.83 KDM4E (0.73) KDM4EL3MBTL1KMT2ANT5EGAA
SCHEMBL1438598 0.83 KDM4E (0.73) KDM4EL3MBTL1KMT2ANT5EGAA
SCHEMBL12440844 0.83 MEN1 (0.52) KDM4EKMT2AGAAPOLBSMN1; SMN2
SCHEMBL2997631 0.83 PTPN1 (0.65) KDM4EKMT2APOLBSMN1; SMN2MEN1
SCHEMBL12993661 0.83 RAB9A (0.70) KDM4EKMT2APOLBMEN1LMNA
SCHEMBL12440876 0.83 NR1H4 (0.62) KDM4EKMT2APOLBSTAT3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8013241-B2 Ionic gel electrolyte, dye-sensitized photoelectric conversion device and solar cell NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2011-09-06 US disclosed
US-7858799-B2 Ionic organic compound NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2010-12-28 US disclosed
US-7858799-B2 Ionic organic compound NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2010-12-28 US disclosed
US-20090266419-A1 IONIC GEL ELECTROLYTE, DYE-SENSITIZED PHOTOELECTRIC CONVERSION DEVICE AND SOLAR CELL NATIONAL INSTITUTE OF ADVANCE INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2009-10-29 US disclosed
US-20080210907-A1 Ionic Organic Compound NAATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2008-09-04 US disclosed
US-20080210907-A1 Ionic Organic Compound NAATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2008-09-04 US 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 (1 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-20080210907-A1 Ionic Organic Compound PCNA, INHA, ADM2 KDM4E 2757/4885L3MBTL1 2059/4885KMT2A 2716/4885

“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.