SCHEMBL28553829

SCHEMBL28553829

O=[N+]([O-])c1cc(Br)c2cccnc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NQO2 P16083 1/20 0.51
▸ POLB P06746 2/20 0.49
▸ MAPT P10636 11/20 0.48
▸ KDM4E B2RXH2 7/20 0.48
▸ HTT P42858 6/20 0.48
▸ TDP1 Q9NUW8 6/20 0.48
▸ SMN1; SMN2 Q16637 5/20 0.48
▸ PKM P14618 4/20 0.48
▸ CASP6 P55212 3/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ NFKB1 P19838 1/20 0.48
▸ NFKB2 Q00653 1/20 0.48
▸ RELA Q04206 1/20 0.48
▸ MEN1 O00255 6/20 0.45
▸ KMT2A Q03164 6/20 0.45
▸ ALDH1A1 P00352 6/20 0.45
▸ CTSB P07858 2/20 0.45
▸ IDO1 P14902 2/20 0.45
▸ TDO2 P48775 2/20 0.45

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
SCHEMBL30918539 0.81 MAPT (0.55) POLBMAPTKDM4EHTTTDP1
SCHEMBL30122661 0.81 MEN1 (0.55) POLBMAPTKDM4EHTTTDP1
SCHEMBL4436189 0.81 MEN1 (0.55) POLBMAPTKDM4EHTTTDP1
SCHEMBL30122630 0.77 MAPT (0.48) POLBMAPTKDM4EHTTTDP1
SCHEMBL27964543 0.77 POLB (0.45) POLBMAPTKDM4EHTTTDP1
SCHEMBL30437811 0.77 MAPT (0.52) POLBMAPTKDM4EHTTTDP1
SCHEMBL25219845 0.75 NQO2 (0.55) NQO2MAPTKDM4EHTTTDP1
SCHEMBL15007822 0.74 MAPT (0.68) NQO2MAPTKDM4EHTTTDP1
SCHEMBL22719670 0.74 KDM4E (0.53) MAPTKDM4EHTTTDP1SMN1; SMN2
SCHEMBL30344938 0.74 KDM4E (0.53) MAPTKDM4EHTTTDP1SMN1; SMN2

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-112574106-B Synthesis method of 7-amino-5-bromoquinoline 苏州康润医药有限公司 2022-04-12 — — CN claimed
CN-112574106-A Synthesis method of 7-amino-5-bromoquinoline 苏州康润医药有限公司 2021-03-30 — — CN claimed
CN-112574106-B Synthesis method of 7-amino-5-bromoquinoline 苏州康润医药有限公司 2022-04-12 — — CN disclosed
CN-112574106-B Synthesis method of 7-amino-5-bromoquinoline 苏州康润医药有限公司 2022-04-12 — — CN disclosed
CN-112574106-A Synthesis method of 7-amino-5-bromoquinoline 苏州康润医药有限公司 2021-03-30 — — CN disclosed
CN-112574106-A Synthesis method of 7-amino-5-bromoquinoline 苏州康润医药有限公司 2021-03-30 — — CN disclosed
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