SCHEMBL29560741

SCHEMBL29560741

CC(C)(C)OC(=O)N1CCC(C#N)(c2ncc(F)cc2Br)CC1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.44
JAK2 O60674 10/20 0.43
JAK1 P23458 10/20 0.43
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
KCNH2 Q12809 1/20 0.38

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
SCHEMBL22866759 1.00 GPR119 (0.44) GPR119JAK2JAK1HDAC1HDAC2
SCHEMBL31046508 0.84 GPR119 (0.41) GPR119JAK2JAK1HDAC1HDAC2
SCHEMBL29335912 0.84 GPR119 (0.41) GPR119JAK2JAK1HDAC1HDAC2
SCHEMBL29335913 0.84 GPR119 (0.41) GPR119JAK2JAK1HDAC1HDAC2
SCHEMBL31046207 0.84 GPR119 (0.41) GPR119JAK2JAK1HDAC1HDAC2
SCHEMBL1995189 0.82 CTSL (0.47) GPR119JAK2JAK1
SCHEMBL3051647 0.82 POLB (0.47) GPR119JAK2JAK1
SCHEMBL22866761 0.82 GPR119 (0.40) GPR119JAK2JAK1HDAC1HDAC2
SCHEMBL31417067 0.81 JAK2 (0.50) GPR119JAK2JAK1HDAC1HDAC2
SCHEMBL31349521 0.80 GPR119 (0.43) GPR119JAK2JAK1

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
CN-114269756-B 4-Oxo-3, 4-dihydropyrido [3,4-D ] pyrimidine compounds that inhibit EIF4E 效应疗法股份有限公司 2024-05-14 CN disclosed
EP-3994139-A1 EIF4E-INHIBITING 4-OXO-3,4-DIHYDROPYRIDO[3,4-D]PYRIMIDINE COMPOUNDS Effector Therapeutics Inc. (US) 2022-05-11 EP disclosed
CN-114269756-A 4-oxo-3, 4-dihydropyrido [3,4-D ] pyrimidine compounds inhibiting EIF4E 效应疗法股份有限公司 2022-04-01 CN disclosed