SCHEMBL25571069

SCHEMBL25571069

CCOC(=O)c1ncccc1C1=CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK4 Q16654 1/20 0.54
GRM1 Q13255 10/20 0.52
GRM5 P41594 10/20 0.52
PDE10A Q9Y233 1/20 0.49
HTR6 P50406 1/20 0.46
JAK1 P23458 1/20 0.45
GABRP O00591 1/20 0.45
GABRD O14764 1/20 0.45
GABRA1 P14867 1/20 0.45
GABRB1 P18505 1/20 0.45
GABRG2 P18507 1/20 0.45
GABRB3 P28472 1/20 0.45
GABRA5 P31644 1/20 0.45
GABRA3 P34903 1/20 0.45
GABRA2 P47869 1/20 0.45
GABRB2 P47870 1/20 0.45
GABRA4 P48169 1/20 0.45
GABRE P78334 1/20 0.45
GABRA6 Q16445 1/20 0.45
GABRG1 Q8N1C3 1/20 0.45

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
SCHEMBL31025087 1.00 PDK4 (0.54) PDK4GRM1GRM5PDE10AHTR6
SCHEMBL2422977 0.89 PDK4 (0.57) PDK4GRM1GRM5PDE10AHTR6
SCHEMBL17655532 0.84 PDK4 (0.61) PDK4GRM1GRM5PDE10AHTR6
SCHEMBL2491264 0.84 PDE10A (0.61) PDK4GRM1GRM5PDE10AJAK1
SCHEMBL16112803 0.83 PDK4 (0.61) PDK4GRM1GRM5HTR6JAK1
SCHEMBL19092559 0.83 PDK4 (0.58) PDK4GRM1GRM5PDE10AHTR6
SCHEMBL5749286 0.82 HTR6 (0.52) PDK4GRM1GRM5PDE10AHTR6
SCHEMBL15951022 0.81 PDK4 (0.60) PDK4GRM1GRM5PDE10AHTR6
SCHEMBL30676170 0.81 GRM5 (0.61) PDK4GRM1GRM5PDE10AHTR6
SCHEMBL2631187 0.81 GRM5 (0.61) PDK4GRM1GRM5PDE10AHTR6

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-20240309013-A1 SYNTHESIS OF 2'-(7,7-dimethyl-1'H,7H-spiro[furo[3,4-b]pyridine-5,4'-piperidin]-1'-yl)-1,3-dihydro-4'H-spiro[indene-2,5'-[1,3]oxazol]-4'-one HOFFMANN-LA ROCHE INC. (US) 2024-09-19 US disclosed
CN-118251396-A Synthesis of 2' - (7, 7-dimethyl-1 ' H, 7H-spiro [ furo [3,4-b ] pyridin-5, 4' -piperidin ] -1' -yl) -1, 3-dihydro-4'H-spiro [ indene-2, 5' - [1,3] oxazol ] -4' -one and crystalline forms thereof 豪夫迈·罗氏有限公司 2024-06-25 CN disclosed
WO-2023088996-A1 SYNTHESIS OF 2'-(7,7-DIMETHYL-1'H,7H-SPIRO[FURO[3,4-B]PYRIDINE-5,4'-PIPERIDIN]-1'-YL)-1,3-DIHYDRO-4'H-SPIRO[INDENE-2,5'-[1,3]OXAZOL]-4'-ONE, AND CRYSTALLINE FORMS THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2023-05-25 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-20240309013-A1 SYNTHESIS OF 2'-(7,7-dimethyl-1'H,7H-spiro[furo[3,4-b]pyridine-5,4'-piperidin]-1'-yl)-1,3-dihydro-4'H-spiro[indene-2,5'-[1,3]oxazol]-4'-one HTR2C, HTR1A, HTR1B PDK4 184/4885GRM1 59/4885GRM5 128/4885

“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.