SCHEMBL20024239

SCHEMBL20024239

c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3cccc4c3oc3nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NPY5R Q15761 1/20 0.34
TSPO P30536 1/20 0.34
PRKDC P78527 7/20 0.33
PIK3CD O00329 3/20 0.33
PIK3CA P42336 3/20 0.33
PIK3CB P42338 3/20 0.33
PIK3CG P48736 3/20 0.33
ALDH1A1 P00352 3/20 0.32
BRD4 O60885 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2C9 P11712 2/20 0.32
BRD2 P25440 2/20 0.32
BRD3 Q15059 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
PIM1 P11309 2/20 0.32
CSNK2A2 P19784 2/20 0.32
CSNK2B P67870 2/20 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
SCHEMBL20024193 0.86 KDM4E (0.33) KDM4EATML3MBTL1NPY5RTSPO
SCHEMBL20030006 0.85 ALOX5 (0.39) KDM4EATML3MBTL1NPY5RPRKDC
SCHEMBL17885352 0.84 KDM4E (0.44) KDM4EATML3MBTL1TSPOPRKDC
SCHEMBL22007492 0.84 KDM4E (0.36) KDM4EATML3MBTL1NPY5RTSPO
SCHEMBL16441451 0.83 KDM4E (0.38) KDM4EATML3MBTL1TSPOPRKDC
SCHEMBL20024233 0.82 L3MBTL1 (0.40) KDM4EATML3MBTL1NPY5RTSPO
SCHEMBL15988940 0.82 KDM4E (0.47) KDM4EATML3MBTL1TSPOPRKDC
SCHEMBL10165773 0.82 KDM4E (0.47) KDM4EATML3MBTL1TSPOPRKDC
SCHEMBL16441597 0.82 KDM4E (0.37) KDM4EATML3MBTL1TSPOPRKDC
SCHEMBL18471391 0.82 KDM4E (0.36) KDM4EATML3MBTL1NPY5RPRKDC

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-2018060218-A1 CARBAZOLES WITH DIAZADIBENZOFURANE OR DIAZADIBENZOTHIOPHENE STRUCTURES MERCK PATENT GMBH (DE) 2018-04-05 WO disclosed