SCHEMBL19933748

SCHEMBL19933748

Cc1cccc2c1c1ccccc1n2-c1cccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ATM Q13315 1/20 0.40
RXFP1 Q9HBX9 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
GAA P10253 1/20 0.37
TSHR P16473 2/20 0.37
PLA2G10 O15496 1/20 0.37
LMNA P02545 2/20 0.36
HSD17B10 Q99714 2/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
NR1I3 Q14994 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PKM P14618 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36

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
SCHEMBL19933750 0.92 MEN1 (0.40) KDM4EL3MBTL1ATMRXFP1MEN1
SCHEMBL19039404 0.89 L3MBTL1 (0.44) KDM4EL3MBTL1ATMRXFP1MEN1
SCHEMBL23370525 0.89 L3MBTL1 (0.44) KDM4EL3MBTL1ATMRXFP1MEN1
SCHEMBL21742779 0.88 L3MBTL1 (0.39) KDM4EL3MBTL1ATMRXFP1MEN1
SCHEMBL18505367 0.88 L3MBTL1 (0.47) KDM4EL3MBTL1ATMRXFP1MEN1
SCHEMBL23606166 0.88 KDM4E (0.46) KDM4EL3MBTL1ATMRXFP1MEN1
SCHEMBL17995360 0.86 L3MBTL1 (0.46) KDM4EL3MBTL1ATMRXFP1MEN1
SCHEMBL16674256 0.86 L3MBTL1 (0.46) KDM4EL3MBTL1ATMRXFP1MEN1
SCHEMBL20315796 0.86 ATM (0.42) KDM4EL3MBTL1ATMRXFP1MEN1
SCHEMBL25966442 0.86 L3MBTL1 (0.50) KDM4EL3MBTL1ATMRXFP1MEN1

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-2018041769-A1 BINUCLEAR AND TRINUCLEAR METAL COMPLEXES COMPOSED OF TWO INTER-LINKED TRIPODAL HEXADENTATE LIGANDS FOR USE IN ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2018-03-08 WO disclosed