SCHEMBL5485899

SCHEMBL5485899

Cn1c(-c2ccncc2)nnc1N1CCOC[C@@H]1c1nc(-c2cccc(Cl)c2)no1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
KCNH2 Q12809 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GRM5 P41594 9/20 0.43
HCRTR1 O43613 2/20 0.42
HCRTR2 O43614 2/20 0.42
MDM2 Q00987 4/20 0.42

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
SCHEMBL5438651 1.00 MAPT (0.43) MAPTKCNH2LMNASMN1; SMN2GRM5
SCHEMBL5483157 1.00 MAPT (0.43) MAPTKCNH2LMNASMN1; SMN2GRM5
SCHEMBL5486686 0.91 GRM5 (0.42) MAPTLMNASMN1; SMN2GRM5HCRTR1
SCHEMBL5435557 0.90 GRM5 (0.36) LMNASMN1; SMN2GRM5
SCHEMBL5485273 0.88 GRM5 (0.42) MAPTLMNASMN1; SMN2GRM5HCRTR1
SCHEMBL5442569 0.88 GRM5 (0.42) MAPTKCNH2LMNASMN1; SMN2GRM5
SCHEMBL5479014 0.87 MAPT (0.45) MAPTLMNASMN1; SMN2GRM5HCRTR1
SCHEMBL5398780 0.87 KCNH2 (0.45) MAPTKCNH2LMNASMN1; SMN2GRM5
SCHEMBL5436283 0.86 HSD11B1 (0.42) MAPTLMNASMN1; SMN2GRM5HCRTR1
SCHEMBL5432191 0.84 KCNH2 (0.41) KCNH2SMN1; SMN2GRM5MDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070185100-A1 Poly-heterocyclic compounds and their use as metabotropic glutamate receptor antagonists ASTRAZENECA AB (SE) 2007-08-09 US disclosed
EP-1716143-A1 POLYHETEROCYCLIC COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS AstraZeneca AB (SE) 2006-11-02 EP disclosed
US-20060025414-A1 Poly-heterocyclic compounds and their use as metabotropic glutamate receptor antagonists ASTRAZENECA AB 2006-02-02 US disclosed
WO-2005080386-A1 POLYHETEROCYCLIC COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS ASTRAZENECA AB (US) 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-20060025414-A1 Poly-heterocyclic compounds and their use as metabotropic glutamate receptor antagonists GRM3, GRM1, GRM4 MAPT 2055/4885KCNH2 359/4885LMNA 3303/4885
US-20070185100-A1 Poly-heterocyclic compounds and their use as metabotropic glutamate receptor antagonists GRM3, GRM1, GRM4 MAPT 1912/4885KCNH2 363/4885LMNA 3378/4885

“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.