SCHEMBL21542263

SCHEMBL21542263

CC(C(=O)N[C@@H]1COc2ccccc2[C@H]1S(C)(=O)=O)c1ccc(Cl)cc1

nearest known ligand 0.81

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 9/20 0.81
P2RX7 Q99572 3/20 0.50
HCRTR2 O43614 1/20 0.40
XIAP P98170 2/20 0.39
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 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
SCHEMBL21542262 1.00 GRM7 (0.81) GRM7P2RX7HCRTR2XIAPKDM4E
SCHEMBL20182834 1.00 GRM7 (0.81) GRM7P2RX7HCRTR2XIAPKDM4E
SCHEMBL20166021 0.91 GRM7 (0.84) GRM7P2RX7
SCHEMBL20166022 0.91 GRM7 (0.84) GRM7P2RX7
SCHEMBL20166023 0.91 GRM7 (0.84) GRM7P2RX7
SCHEMBL20165951 0.90 GRM7 (1.00) GRM7P2RX7MEN1KMT2A
SCHEMBL20165953 0.90 GRM7 (1.00) GRM7P2RX7MEN1KMT2A
SCHEMBL20165948 0.90 GRM7 (1.00) GRM7P2RX7MEN1KMT2A
SCHEMBL21542222 0.83 GRM7 (0.57) GRM7P2RX7HCRTR2XIAPKDM4E
SCHEMBL21542223 0.83 GRM7 (0.57) GRM7P2RX7HCRTR2XIAPKDM4E

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-3541812-B1 MGLUR7 AGONIST COMPOUNDS FOR TREATING MGLUR7- REGULATED DISEASES, DISORDERS, OR CONDITIONS TAKEDA PHARMACEUTICALS CO (JP) 2023-06-14 EP claimed
US-11465994-B2 MGluR7 agonist compounds for treating mGluR7-regulated diseases, disorders, or conditions TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-10-11 US claimed
US-20190345148-A1 MGLUR7 AGONIST COMPOUNDS FOR TREATING MGLUR7-REGULATED DISEASES, DISORDERS, OR CONDITIONS TAKEDA CAMBRIDGE LIMITED (GB) 2019-11-14 US claimed
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
US-20190345148-A1 MGLUR7 AGONIST COMPOUNDS FOR TREATING MGLUR7-REGULATED DISEASES, DISORDERS, OR CONDITIONS TAKEDA CAMBRIDGE LIMITED (GB) 2019-11-14 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-11465994-B2 MGluR7 agonist compounds for treating mGluR7-regulated diseases, disorders, or conditions GRM7, GRM2, GRM1 GRM7 1/4885P2RX7 287/4885HCRTR2 86/4885
US-20190345148-A1 MGLUR7 AGONIST COMPOUNDS FOR TREATING MGLUR7-REGULATED DISEASES, DISORDERS, OR CONDITIONS GRM7, GRM2, GRM1 GRM7 1/4885P2RX7 287/4885HCRTR2 86/4885

“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.