SCHEMBL8236497

SCHEMBL8236497

CCOC(=O)c1c(N=CN(C)C)c2c(N(C)C)ccnc2n1C

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.61
HTT P42858 5/20 0.61
HSD17B10 Q99714 3/20 0.61
CASP1 P29466 1/20 0.61
CASP7 P55210 1/20 0.61
MAPT P10636 6/20 0.54
KMT2A Q03164 2/20 0.54
ALDH1A1 P00352 9/20 0.48
LMNA P02545 4/20 0.48
NCOA1 Q15788 1/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
TDP1 Q9NUW8 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
GAA P10253 3/20 0.36
MAPK1 P28482 1/20 0.35
MEN1 O00255 1/20 0.35
JMJD6 Q6NYC1 1/20 0.35
TSHR P16473 1/20 0.34

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
SCHEMBL8276659 1.00 KDM4E (0.61) KDM4EHTTHSD17B10CASP1CASP7
SCHEMBL8238335 0.80 MAPT (0.46) KDM4EHTTHSD17B10CASP1CASP7
SCHEMBL6826313 0.72 KMT2A (0.46) KDM4EHTTHSD17B10CASP1CASP7
SCHEMBL8276657 0.72 KDM4E (0.46) KDM4EHTTHSD17B10CASP1CASP7
SCHEMBL8242897 0.72 KDM4E (0.46) KDM4EHTTHSD17B10CASP1CASP7
SCHEMBL6922023 0.70 ALDH1A1 (0.45) KDM4EHTTHSD17B10CASP1CASP7
SCHEMBL6922029 0.70 ALDH1A1 (0.45) KDM4EHTTHSD17B10CASP1CASP7
SCHEMBL12347774 0.65 KDM4E (0.49) KDM4EHTTHSD17B10CASP1CASP7
SCHEMBL6101444 0.65 KDM4E (0.78) KDM4EHTTHSD17B10CASP1CASP7
SCHEMBL6101448 0.65 KDM4E (0.78) KDM4EHTTHSD17B10CASP1CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989464-B2 mGluR1 antagonists as therapeutic agents SCHERING CORPORATION (US) 2011-08-02 US disclosed
US-7989464-B2 mGluR1 antagonists as therapeutic agents SCHERING CORPORATION (US) 2011-08-02 US disclosed
US-7598259-B2 mGluR1 antagonists as therapeutic agents SCHERING CORPORATION (US) 2009-10-06 US disclosed
US-7598259-B2 mGluR1 antagonists as therapeutic agents SCHERING CORPORATION (US) 2009-10-06 US disclosed
US-20090192178-A1 mGluR1 ANTAGONISTS AS THERAPEUTIC AGENTS SCHERING CORPORATION 2009-07-30 US disclosed
US-20090192178-A1 mGluR1 ANTAGONISTS AS THERAPEUTIC AGENTS SCHERING CORPORATION 2009-07-30 US disclosed
US-20090082336-A1 mGluR1 Antagonists as Therapeutic Agents SCHERING CORPORATION 2009-03-26 US disclosed
US-20090082336-A1 mGluR1 Antagonists as Therapeutic Agents SCHERING CORPORATION 2009-03-26 US disclosed
US-7485648-B2 mGluR1 antagonists as therapeutic agents SCHERING CORPORATION (US) 2009-02-03 US disclosed
US-7485648-B2 mGluR1 antagonists as therapeutic agents SCHERING CORPORATION (US) 2009-02-03 US disclosed
US-20060167029-A1 mGluR1 Antagonists as therapeutic agents SCHERING CORPORATION 2006-07-27 US disclosed
US-20060167029-A1 mGluR1 Antagonists as therapeutic agents SCHERING CORPORATION 2006-07-27 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 (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-20090192178-A1 mGluR1 ANTAGONISTS AS THERAPEUTIC AGENTS GRM1, GRM4, GRIA1 KDM4E 1129/4885HTT 374/4885HSD17B10 1997/4885
US-20060167029-A1 mGluR1 Antagonists as therapeutic agents GRM1, GRM4, GRIA1 KDM4E 1129/4885HTT 374/4885HSD17B10 1997/4885
US-20090082336-A1 mGluR1 Antagonists as Therapeutic Agents GRM1, GRM4, GRIA1 KDM4E 1129/4885HTT 374/4885HSD17B10 1997/4885

“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.