SCHEMBL20399718

SCHEMBL20399718

O=C(O)[C@H]1CC(F)(F)CCN1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACE P12821 4/20 0.31
GRM2 Q14416 1/20 0.31
GRM3 Q14832 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
SCHEMBL28022736 1.00 ACE (0.31) ACEGRM2GRM3
SCHEMBL15114474 0.81 TSHR (0.38)
SCHEMBL3512916 0.80 GRM2 (0.36) GRM2GRM3
SCHEMBL6919995 0.80 GRM2 (0.36) GRM2GRM3
SCHEMBL4254372 0.80 GRM2 (0.36) GRM2GRM3
SCHEMBL2026722 0.78
SCHEMBL2023665 0.78 CHRM2 (0.31)
SCHEMBL22518862 0.78 CYP2C19 (0.33) GRM2GRM3
SCHEMBL22518863 0.78 CYP2C19 (0.33) GRM2GRM3
SCHEMBL10215476 0.77 HSD17B10 (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110248949-B Immunoproteasome inhibitors 普林斯匹亚生物制药公司 2023-02-17 CN disclosed
US-11154563-B2 Immunoproteasome inhibitors PRINCIPIA BIOPHARMA INC. (US) 2021-10-26 US disclosed
EP-3571208-B1 IMMUNOPROTEASOME INHIBITORS PRINCIPIA BIOPHARMA INC (US) 2021-03-10 EP disclosed
US-20190336515-A1 IMMUNOPROTEASOME INHIBITORS PRINCIPIA BIOPHARMA INC. 2019-11-07 US disclosed
WO-2018136401-A1 IMMUNOPROTEASOME INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2018-07-26 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-11154563-B2 Immunoproteasome inhibitors PSMC2, PSMB7, PSMB2 ACE 128/4885GRM2 4115/4885GRM3 4640/4885
US-20190336515-A1 IMMUNOPROTEASOME INHIBITORS PSMC2, PSMB7, PSMB2 ACE 128/4885GRM2 4115/4885GRM3 4640/4885

“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.