SCHEMBL28490620

SCHEMBL28490620

O=C(Oc1ccc(Br)cc1)c1ccccn1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.66
▸ KDM4E B2RXH2 7/20 0.66
▸ POLB P06746 1/20 0.66
▸ L3MBTL1 Q9Y468 8/20 0.58
▸ GAA P10253 2/20 0.58
▸ ALDH1A1 P00352 7/20 0.58
▸ SMN1; SMN2 Q16637 1/20 0.58
▸ TP53 P04637 1/20 0.53
▸ TLR7 Q9NYK1 1/20 0.53
▸ CASP3 P42574 1/20 0.52
▸ SENP8 Q96LD8 1/20 0.52
▸ SENP7 Q9BQF6 1/20 0.52
▸ SENP6 Q9GZR1 1/20 0.52
▸ KMT2A Q03164 4/20 0.52
▸ TDP1 Q9NUW8 1/20 0.51
▸ PTGS2 P35354 1/20 0.49
▸ CES2 O00748 1/20 0.48
▸ CES1 P23141 1/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ RAB9A P51151 1/20 0.48

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
SCHEMBL3961211 0.86 MAPT (0.69) MAPTKDM4EPOLBL3MBTL1GAA
SCHEMBL30185288 0.86 MAPT (0.69) MAPTKDM4EPOLBL3MBTL1GAA
SCHEMBL5258714 0.83 MAPT (0.66) MAPTKDM4EPOLBL3MBTL1GAA
SCHEMBL12110235 0.83 MAPT (0.66) MAPTKDM4EPOLBL3MBTL1GAA
SCHEMBL31664396 0.82 KDM4E (0.68) MAPTKDM4EPOLBL3MBTL1GAA
SCHEMBL7422658 0.80 MAPT (0.61) MAPTKDM4EPOLBL3MBTL1GAA
SCHEMBL27665086 0.80 MAPT (1.00) MAPTKDM4EPOLBL3MBTL1GAA
SCHEMBL12108493 0.80 MAPT (0.61) MAPTKDM4EPOLBL3MBTL1GAA
SCHEMBL8701481 0.78 KMT2A (0.62) MAPTKDM4EPOLBL3MBTL1GAA
SCHEMBL28490622 0.77 GRM4 (0.65) MAPTKDM4EPOLBL3MBTL1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112011098-B Supermolecule luminescent gel system constructed by sulfonated cyclodextrin-bromophenyl picolinate-amino clay and preparation method thereof 南开大学 2022-04-29 — — CN claimed
CN-112011098-A Supermolecule luminescent gel system constructed by sulfonated cyclodextrin-bromophenyl picolinate-amino clay and preparation method thereof 南开大学 2020-12-01 — — CN claimed
CN-112011098-B Supermolecule luminescent gel system constructed by sulfonated cyclodextrin-bromophenyl picolinate-amino clay and preparation method thereof 南开大学 2022-04-29 — — CN disclosed
CN-112011098-B Supermolecule luminescent gel system constructed by sulfonated cyclodextrin-bromophenyl picolinate-amino clay and preparation method thereof 南开大学 2022-04-29 — — CN disclosed
CN-112011098-B Supermolecule luminescent gel system constructed by sulfonated cyclodextrin-bromophenyl picolinate-amino clay and preparation method thereof 南开大学 2022-04-29 — — CN disclosed
CN-112011098-A Supermolecule luminescent gel system constructed by sulfonated cyclodextrin-bromophenyl picolinate-amino clay and preparation method thereof 南开大学 2020-12-01 — — CN disclosed
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