SCHEMBL28617322

SCHEMBL28617322

CC(=O)c1ccccc1NC(=O)c1ncccc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.52
ALDH1A1 P00352 3/20 0.51
HSD17B10 Q99714 2/20 0.51
MAPT P10636 1/20 0.51
POLB P06746 1/20 0.49
KDR P35968 1/20 0.49
KMT2A Q03164 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
CA12 O43570 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
KIT P10721 1/20 0.47
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
PTPN1 P18031 1/20 0.46
TYK2 P29597 1/20 0.46

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
SCHEMBL28438962 0.86 HPGD (0.57) KDM4EALDH1A1HSD17B10MAPTPOLB
SCHEMBL31087265 0.84 KDM4E (0.48) KDM4EALDH1A1MAPTKMT2AL3MBTL1
SCHEMBL29643993 0.84 L3MBTL1 (0.53) KDM4EALDH1A1MAPTL3MBTL1NPC1
SCHEMBL31087263 0.84 KDR (0.53) KDM4EALDH1A1MAPTKDRKMT2A
SCHEMBL28610628 0.84 L3MBTL1 (0.53) KDM4EALDH1A1MAPTL3MBTL1NPC1
SCHEMBL5936350 0.80 HTT (0.60) KDM4EALDH1A1MAPTKDRKMT2A
SCHEMBL28611795 0.79 HDAC6 (0.62) KDM4EALDH1A1MAPTNPC1RAB9A
SCHEMBL31087264 0.79 HDAC6 (0.62) KDM4EALDH1A1MAPTNPC1RAB9A
SCHEMBL28499436 0.79 KDM4E (0.66) KDM4EALDH1A1HSD17B10MAPTKDR
SCHEMBL30025270 0.76 RAB9A (0.65) KDM4EHSD17B10MAPTPOLBKDR

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-113278007-B Synthetic method of 2-hydroxy-indole-3-ketone compound 延安大学 2022-05-17 CN disclosed
CN-113278007-A Synthetic method of 2-hydroxy-indole-3-ketone compound 延安大学 2021-08-20 CN disclosed