SCHEMBL29907236

SCHEMBL29907236

CC(C)(C)OC(=O)N1CCC(c2cccc3[nH]cnc23)CC1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.52
JAK1 P23458 2/20 0.52
TYK2 P29597 2/20 0.52
JAK3 P52333 1/20 0.52
PDE10A Q9Y233 1/20 0.50
HPGDS O60760 2/20 0.48
PARP1 P09874 5/20 0.48
GPR119 Q8TDV5 3/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
THRB P10828 1/20 0.46

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
SCHEMBL19297242 1.00 JAK2 (0.52) JAK2JAK1TYK2JAK3PDE10A
SCHEMBL22608960 0.94 HPGDS (0.50) JAK2JAK1TYK2JAK3PDE10A
SCHEMBL2347633 0.83 PDE10A (0.54) JAK2JAK1TYK2JAK3PDE10A
SCHEMBL29844615 0.82 JAK2 (0.52) JAK2JAK1TYK2JAK3GPR119
SCHEMBL29337387 0.81 DRD2 (0.51) PARP1GPR119MAPT
SCHEMBL23442909 0.80 GPR119 (0.51) JAK2JAK1TYK2JAK3PDE10A
SCHEMBL30368710 0.80 GPR119 (0.51) JAK2JAK1TYK2JAK3PDE10A
SCHEMBL19284734 0.80 GPR119 (0.54) JAK2JAK3PDE10AHPGDSGPR119
SCHEMBL14143336 0.80 JAK1 (0.57) JAK2JAK1TYK2JAK3PDE10A
SCHEMBL19297153 0.78 GPR119 (0.46) JAK2JAK1TYK2JAK3PDE10A

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
EP-4326719-A1 PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS USES THEREOF FOR TREATING A PROLIFERATIVE DISEASE Université de Montréal (CA) 2024-02-28 EP disclosed
CN-117177973-A Pyrido [3,2-D ] pyrimidine compounds and their use for the treatment of proliferative disorders 蒙特利尔大学 2023-12-05 CN disclosed
WO-2022221939-A1 PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS USES THEREOF FOR TREATING A PROLIFERATIVE DISEASE UNIVERSITE DE MONTREAL (CA) 2022-10-27 WO disclosed