SCHEMBL30366200

SCHEMBL30366200

CC(C)(C)OC(=O)N1CCC[C@H](C(=O)Nc2cccc3cccnc23)C1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.56
LMNA P02545 3/20 0.54
EPHX2 P34913 1/20 0.54
HTT P42858 2/20 0.52
ALDH1A1 P00352 1/20 0.52
POLB P06746 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
MAPK1 P28482 2/20 0.50
TSHR P16473 1/20 0.50
KDM4E B2RXH2 1/20 0.50
NPSR1 Q6W5P4 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL30899633 1.00 GAA (0.56) GAALMNAEPHX2HTTALDH1A1
SCHEMBL30089037 1.00 GAA (0.56) GAALMNAEPHX2HTTALDH1A1
SCHEMBL30098447 0.94 EPHX2 (0.58) GAALMNAEPHX2HTTALDH1A1
SCHEMBL28932946 0.94 EPHX2 (0.58) GAALMNAEPHX2HTTALDH1A1
SCHEMBL30098558 0.94 EPHX2 (0.58) GAALMNAEPHX2HTTALDH1A1
SCHEMBL23951732 0.94 EPHX2 (0.58) GAALMNAEPHX2HTTALDH1A1
SCHEMBL28932952 0.94 EPHX2 (0.58) GAALMNAEPHX2HTTALDH1A1
SCHEMBL27177201 0.85 GAA (0.57) GAALMNAEPHX2HTTALDH1A1
SCHEMBL30679668 0.84 USP30 (0.50) POLBKDM4E
SCHEMBL29136079 0.84 USP30 (0.50) POLBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240360126-A1 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE HOFFMANN-LA ROCHE INC. (US) 2024-10-31 US disclosed
EP-4405051-A1 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE F. Hoffmann-La Roche AG (CH) 2024-07-31 EP disclosed
WO-2023046806-A1 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2023-03-30 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 (1 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-20240360126-A1 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE SSB, TPMT, KCNB2 GAA 3447/4885LMNA 3525/4885EPHX2 3302/4885

“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.