SCHEMBL6264176

SCHEMBL6264176

CC(O)c1ccccc1-c1cc(Br)ccc1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 1/20 0.40
MAPT P10636 6/20 0.38
POLB P06746 2/20 0.38
HTT P42858 4/20 0.37
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
RAB9A P51151 1/20 0.37
IDO1 P14902 1/20 0.36
GPR35 Q9HC97 1/20 0.36
KDM4E B2RXH2 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.33
ALDH1A1 P00352 2/20 0.33
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33
MAPK1 P28482 3/20 0.33
NPC1 O15118 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL5047633 0.81 RECQL (0.41) HTTMEN1KMT2AIDO1ALDH1A1
SCHEMBL5049925 0.81 RECQL (0.41) HTTMEN1KMT2AIDO1ALDH1A1
SCHEMBL5322587 0.81 RECQL (0.41) HTTMEN1KMT2AIDO1ALDH1A1
SCHEMBL3984863 0.77 KDM4E (0.42) MAPTPOLBHTTMEN1KMT2A
SCHEMBL5907397 0.76 GABRA1 (0.44) PTPRCMAPTPOLBHTTMEN1
SCHEMBL11518803 0.74 GPR35 (0.53) PTPRCMAPTPOLBHTTMEN1
SCHEMBL29573133 0.74 GPR35 (0.53) PTPRCMAPTPOLBHTTMEN1
SCHEMBL28923513 0.74 PTPRC (0.46) PTPRCMAPTPOLBHTTMEN1
SCHEMBL3398674 0.74 SLC6A3 (0.44) PTPRCMAPTHTTMEN1KMT2A
SCHEMBL2011606 0.74 P2RX3 (0.37) MAPTPOLBHTTMEN1KMT2A

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
WO-2005095366-A1 7-ARYL 1,5-DIHYDRO-4,1-BENZOXAZEPIN-2(3H)-ONE DERIVATIVES AND THEIR USE AS PROGESTERONE RECEPTOR MODULATORS WYETH (US) 2005-10-13 WO disclosed