SCHEMBL29909556

SCHEMBL29909556

O=C(Nc1ccc(Oc2ccc(Cl)cn2)c(Cl)c1)c1ccccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 13/20 1.00
GRM8 O00222 1/20 1.00
GRM7 Q14831 1/20 1.00
NPC1 O15118 2/20 0.61
RAB9A P51151 2/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
MAPT P10636 1/20 0.61
NFKB1 P19838 1/20 0.61
NFKB2 Q00653 1/20 0.61
RELA Q04206 1/20 0.61
HDAC6 Q9UBN7 2/20 0.56
KDM4E B2RXH2 1/20 0.55
KDR P35968 1/20 0.54
PNLIP P16233 2/20 0.52
ALDH1A1 P00352 1/20 0.51

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
SCHEMBL20166019 1.00 GRM4 (1.00) GRM4GRM8GRM7NPC1RAB9A
SCHEMBL2529723 0.89 GRM4 (0.80) GRM4GRM8GRM7NPC1RAB9A
SCHEMBL2535702 0.86 GRM4 (0.76) GRM4GRM8GRM7NPC1RAB9A
SCHEMBL2532528 0.85 GRM4 (0.73) GRM4GRM8GRM7NPC1RAB9A
SCHEMBL2533496 0.83 GRM4 (0.74) GRM4GRM8GRM7NPC1RAB9A
SCHEMBL2530375 0.83 GRM4 (0.74) GRM4GRM8GRM7NPC1RAB9A
SCHEMBL2529601 0.81 GRM4 (0.67) GRM4GRM8GRM7NPC1RAB9A
SCHEMBL2533211 0.79 GRM4 (0.65) GRM4GRM8GRM7NPC1RAB9A
SCHEMBL2535716 0.78 GRM4 (0.67) GRM4GRM8GRM7NPC1RAB9A
SCHEMBL2528005 0.76 GRM4 (0.64) GRM4GRM8GRM7NPC1RAB9A

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-12156879-B2 Combining BACE1 inhibitors with mGluR agonists for Alzheimer's disease therapy UNIVERSITY OF CONNECTICUT (US) 2024-12-03 US claimed
US-12156879-B2 Combining BACE1 inhibitors with mGluR agonists for Alzheimer's disease therapy UNIVERSITY OF CONNECTICUT (US) 2024-12-03 US disclosed
EP-3541812-B1 MGLUR7 AGONIST COMPOUNDS FOR TREATING MGLUR7- REGULATED DISEASES, DISORDERS, OR CONDITIONS TAKEDA PHARMACEUTICALS CO (JP) 2023-06-14 EP disclosed
US-11465994-B2 MGluR7 agonist compounds for treating mGluR7-regulated diseases, disorders, or conditions TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-10-11 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 (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-12156879-B2 Combining BACE1 inhibitors with mGluR agonists for Alzheimer's disease therapy BACE1, PSEN1, PSEN2 GRM4 17/4885GRM8 22/4885GRM7 15/4885
US-11465994-B2 MGluR7 agonist compounds for treating mGluR7-regulated diseases, disorders, or conditions GRM7, GRM2, GRM1 GRM4 11/4885GRM8 13/4885GRM7 1/4885

“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.