SCHEMBL3978664

SCHEMBL3978664

CN(C)c1ccc(C(=O)NN)cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.50
HCAR3 P49019 2/20 0.46
MAPT P10636 2/20 0.44
MPO P05164 2/20 0.44
CYP3A4 P08684 2/20 0.44
KDM5A P29375 1/20 0.44
BLM P54132 1/20 0.44
GFER P55789 1/20 0.44
PMP22 Q01453 1/20 0.44
HIF1A Q16665 1/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 2/20 0.43
OGG1 O15527 1/20 0.43
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CYP1A2 P05177 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL2566647 0.83 HPGDS (0.47) HPGDSHCAR3KDM4EALDH1A1HDAC1
SCHEMBL976946 0.80 NNMT (0.55) HPGDSHCAR3KDM4EALDH1A1L3MBTL1
SCHEMBL26151729 0.80 HPGDS (0.48) HPGDSHCAR3MAPTLMNAHDAC1
SCHEMBL6755755 0.80 MLYCD (0.52) HPGDSHCAR3KDM4EKMT2ANAMPT
SCHEMBL12734188 0.80 HCAR3 (0.49) HPGDSHCAR3MAPTKDM4EALDH1A1
Hydrochloric Acid SCHEMBL2674517 0.79 NNMT (0.53) HPGDSHCAR3KDM4EALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL5009849 0.79 NNMT (0.53) HPGDSHCAR3KDM4EALDH1A1L3MBTL1
SCHEMBL185127 0.78 HCAR3 (0.65) HCAR3MAPTKDM4EALDH1A1CYP1A2
SCHEMBL28865950 0.78 HCAR3 (0.49) HPGDSHCAR3KDM4EALDH1A1P4HTM
Hydrochloric Acid SCHEMBL9670823 0.78 HCAR3 (0.45) HPGDSHCAR3KDM4EALDH1A1AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090111823-A1 AMINOPYRIDINE DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2009-04-30 US claimed
WO-2009054792-A1 AMINOPYRIDINE DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2009-04-30 WO claimed
US-20090111823-A1 AMINOPYRIDINE DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2009-04-30 US disclosed
US-20090111823-A1 AMINOPYRIDINE DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2009-04-30 US disclosed
US-20090111823-A1 AMINOPYRIDINE DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2009-04-30 US disclosed
WO-2009054792-A1 AMINOPYRIDINE DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2009-04-30 WO disclosed
WO-2009054792-A1 AMINOPYRIDINE DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2009-04-30 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 (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-20090111823-A1 AMINOPYRIDINE DERIVATIVES AS MODULATORS OF MGLUR5 GRM5, GRIK5, GRM2 HPGDS 1125/4885HCAR3 229/4885MAPT 898/4885

“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.