SCHEMBL29615664

SCHEMBL29615664

Oc1c(Br)c(Br)c(O)c2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.48
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 2/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 2/20 0.46
GAA P10253 1/20 0.46
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
IDO1 P14902 1/20 0.45
RECQL P46063 2/20 0.44
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
ALOX15 P16050 1/20 0.44
MAPK1 P28482 1/20 0.44
HIF1A Q16665 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
SCHEMBL8210689 0.88 POLB (0.44) POLBALDH1A1KDM4EMEN1MAPT
SCHEMBL16515849 0.86 CA1 (0.45) POLBALDH1A1KDM4EMEN1MAPT
SCHEMBL12377557 0.82 LMNA (0.45) POLBALDH1A1KDM4EMEN1MAPT
SCHEMBL2468887 0.81 POLB (0.48) POLBALDH1A1KDM4EMEN1MAPT
SCHEMBL526630 0.79 IDO1 (0.56) POLBALDH1A1KDM4EMEN1MAPT
SCHEMBL29291851 0.77 HMGB1 (0.46) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL7206760 0.76 IDO1 (0.53) POLBALDH1A1KDM4EMEN1MAPT
SCHEMBL888293 0.76 PADI4 (0.55) POLBALDH1A1KDM4EMEN1MAPT
SCHEMBL30503415 0.76 PADI4 (0.55) POLBALDH1A1KDM4EMEN1MAPT
SCHEMBL29648165 0.76 IDO1 (0.53) POLBALDH1A1KDM4EMEN1MAPT

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-113292503-B Preparation method of 2-bromo-3-aminonaphthoquinone compound 台州市第一人民医院 2022-05-13 CN disclosed