SCHEMBL28499278

SCHEMBL28499278

Brc1ncn(Cc2cccnc2)c1-c1c[nH]c2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ HTR7 P34969 1/20 0.43
▸ HTR6 P50406 1/20 0.43
▸ ALOX5 P09917 1/20 0.43
▸ PKM P14618 1/20 0.42
▸ MAPK10 P53779 1/20 0.42
▸ MDM4 O15151 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ MDM2 Q00987 1/20 0.42
▸ KIF20A O95235 1/20 0.42
▸ HTT P42858 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ PTGER2 P43116 1/20 0.41
▸ POLB P06746 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ CYP19A1 P11511 1/20 0.39
▸ TBXAS1 P24557 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL28508740 0.88 TP53 (0.52) KDM4EHTR7HTR6MDM4TP53
SCHEMBL28501215 0.87 KDM4E (0.50) KDM4EL3MBTL1HTR7HTR6ALOX5
SCHEMBL28904632 0.83 MDM2 (0.60) HTR7HTR6ALOX5MDM4TP53
SCHEMBL28506801 0.82 TP53 (0.48) KDM4EL3MBTL1HTR7HTR6MDM4
SCHEMBL28503127 0.82 MDM4 (0.48) KDM4EL3MBTL1HTR7HTR6MDM4
SCHEMBL28505102 0.81 CYP11B1 (0.49) HTR7HTR6MDM4TP53MDM2
SCHEMBL28508702 0.81 MDM4 (0.44) HTR7HTR6MDM4TP53MDM2
SCHEMBL28498122 0.79 HTR7 (0.65) KDM4EL3MBTL1HTR7HTR6ALOX5
SCHEMBL28497091 0.79 MDM4 (0.46) HTR7HTR6MDM4TP53MDM2
SCHEMBL28495988 0.79 HTR1A (0.51) HTR7HTR6MDM4TP53MDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112174937-B 3- (5-imidazolyl) indole compound and preparation method and application thereof 南京农业大学 2022-06-03 — — CN disclosed
CN-112174937-A 3- (5-imidazolyl) indole compound and preparation method and application thereof 南京农业大学 2021-01-05 — — CN disclosed
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