SCHEMBL29671886

SCHEMBL29671886

Cn1c(=O)c2c(NCC(=O)Nc3cccc(C(F)(F)F)c3)cc(N3CCOCC3)nc2n(C)c1=O

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 5/20 0.55
▸ MAPT P10636 1/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ HTT P42858 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ RXFP1 Q9HBX9 1/20 0.51
▸ RAF1 P04049 7/20 0.49
▸ BRAF P15056 7/20 0.49
▸ KMT2A Q03164 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ PIK3CD O00329 1/20 0.44
▸ PIK3CB P42338 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ RAB9A P51151 1/20 0.44

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
SCHEMBL28755083 1.00 AKT1 (0.55) AKT1MAPTSMN1; SMN2HTTNPSR1
SCHEMBL28755086 0.93 MAPT (0.56) AKT1MAPTSMN1; SMN2HTTNPSR1
SCHEMBL29671926 0.93 MAPT (0.56) AKT1MAPTSMN1; SMN2HTTNPSR1
SCHEMBL29671962 0.91 LMNA (0.51) AKT1MAPTSMN1; SMN2KMT2ALMNA
SCHEMBL28755175 0.91 LMNA (0.51) AKT1MAPTSMN1; SMN2KMT2ALMNA
SCHEMBL28755219 0.89 PIK3CB (0.54) AKT1MAPTSMN1; SMN2KMT2APIK3CD
SCHEMBL29671929 0.89 PIK3CB (0.54) AKT1MAPTSMN1; SMN2KMT2APIK3CD
SCHEMBL29671952 0.85 PIK3CD (0.57) AKT1MAPTNPSR1LMNAPIK3CD
SCHEMBL28755300 0.85 PIK3CD (0.57) AKT1MAPTNPSR1LMNAPIK3CD
SCHEMBL29671991 0.84 PIK3CD (0.48) AKT1MAPTKMT2APIK3CDPIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114573582-B 1,2,3, 4-tetrahydropyrido [2,3-d ] pyrimidine compound and preparation method and application thereof 沈阳药科大学 2023-06-16 — — CN claimed
CN-114573582-A 1,2,3, 4-tetrahydropyrido [2,3-d ] pyrimidine compound and preparation method and application thereof 沈阳药科大学 2022-06-03 — — CN claimed
CN-114573582-B 1,2,3, 4-tetrahydropyrido [2,3-d ] pyrimidine compound and preparation method and application thereof 沈阳药科大学 2023-06-16 — — CN disclosed
CN-114573582-A 1,2,3, 4-tetrahydropyrido [2,3-d ] pyrimidine compound and preparation method and application thereof 沈阳药科大学 2022-06-03 — — CN disclosed
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