SCHEMBL28928821

SCHEMBL28928821

COCOc1ccc(C(=O)CNC(=O)c2ccc[nH]2)cc1OCOC

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.47
▸ HRH3 Q9Y5N1 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ TP53 P04637 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ITGB3 P05106 5/20 0.40
▸ ITGA2B P08514 5/20 0.40
▸ LMNA P02545 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ RAB9A P51151 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
SCHEMBL28928832 0.85 NPC1 (0.45) GAAKDM4EKMT2ALMNANPC1
SCHEMBL28928852 0.84 GAA (0.42) GAAKDM4ELMNANPC1RAB9A
SCHEMBL28928839 0.82 DAO (0.44) HRH3KMT2AITGB3ITGA2B
SCHEMBL28928836 0.82 KDM4E (0.43) GAAHRH3KDM4EKMT2ALMNA
SCHEMBL28929413 0.78 GAA (0.45) GAAHRH3KDM4ELMNA
SCHEMBL28929418 0.77 NPC1 (0.59) GAAKDM4EKMT2ANPC1RAB9A
SCHEMBL28928858 0.75 NPC1 (0.44) GAAKDM4ELMNANPC1MAPT
SCHEMBL28928859 0.73 POLB (0.52) GAAKDM4ELMNARAB9A
SCHEMBL28928823 0.72 LMNA (0.65) KDM4EKMT2ALMNANPC1MAPT
SCHEMBL28928830 0.72 MEN1 (0.64) GAAKDM4EKMT2ALMNANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115583942-A 2-substituted 5-phenyl-oxazole derivative, preparation method thereof and application thereof as MNK (MNK) inhibitor 中国海洋大学 2023-01-10 — — CN disclosed
Send feedback