SCHEMBL2897213

SCHEMBL2897213

CC(c1nnn(-c2cccc(Cl)c2)n1)N(C)c1nnc(-c2cc(F)cc(F)c2)n1C

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 6/20 0.47
PKM P14618 1/20 0.33
HSD11B1 P28845 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
MET P08581 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
MCOLN2 Q8IZK6 1/20 0.31

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
SCHEMBL2897842 0.88 GRM5 (0.48) GRM5PKMHSD11B1ALDH1A1TSHR
SCHEMBL2900383 0.85 GRM5 (0.47) GRM5TSHR
SCHEMBL2892870 0.80 GRM5 (0.48) GRM5PKMHSD11B1ALDH1A1TSHR
SCHEMBL2897207 0.80 GRM5 (0.48) GRM5PKMALDH1A1MCOLN2
SCHEMBL5482144 0.80 GRM5 (0.71) GRM5PKMMCOLN2
SCHEMBL2889851 0.80 GRM5 (0.71) GRM5PKMMCOLN2
SCHEMBL2897209 0.78 GRM5 (0.46) GRM5PKMALDH1A1TRPV1MCOLN2
SCHEMBL2889468 0.78 GRM5 (0.45) GRM5ALDH1A1
SCHEMBL13703848 0.77 KCNH2 (0.51) GRM5PKMTSHR
SCHEMBL1543901 0.77 KCNH2 (0.51) GRM5PKMTSHR

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
EP-1716125-B1 TETRAZOLE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONITS ASTRAZENECA AB (SE) 2013-06-19 EP disclosed
US-7691892-B2 Tetrazole compounds and their use as metabotropic glutamate receptor antagonists ASTRAZENECA AB (SE) 2010-04-06 US disclosed
US-20070197549-A1 Tetrazole compounds and their use as metabotropic glutamate receptor antagonists ASTRAZENECA AB (SE) 2007-08-23 US disclosed
EP-1716125-A1 TETRAZOLE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONITS AstraZeneca AB (SE) 2006-11-02 EP disclosed
US-20060004021-A1 Tetrazole compounds and their use as metabotropic glutamate receptor antagonists ASTRAZENECA AB 2006-01-05 US disclosed
WO-2005080356-A1 TETRAZOLE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONITS ASTRAZENECA AB (SE) 2005-09-01 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 (2 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-20060004021-A1 Tetrazole compounds and their use as metabotropic glutamate receptor antagonists GRM1, GRM3, GRM4 GRM5 10/4885PKM 1183/4885HSD11B1 3330/4885
US-20070197549-A1 Tetrazole compounds and their use as metabotropic glutamate receptor antagonists GRM1, GRM3, GRM4 GRM5 10/4885PKM 1245/4885HSD11B1 3349/4885

“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.