SCHEMBL28083091

SCHEMBL28083091

c1ccc(-c2cc3ncccc3nc2-c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 4/20 0.51
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
KDM4E B2RXH2 4/20 0.47
PKM P14618 1/20 0.47
PSMB5 P28074 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
AKT1 P31749 2/20 0.46
AKT2 P31751 1/20 0.46
LMNA P02545 2/20 0.46
GAA P10253 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 3/20 0.45
NPC1 O15118 1/20 0.45
PDE10A Q9Y233 1/20 0.43
ATM Q13315 1/20 0.43
TLR9 Q9NR96 1/20 0.43

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
SCHEMBL27653760 0.92 MEN1 (0.65) TOP1KMT2AMEN1KDM4EPSMB5
SCHEMBL3702970 0.91 MEN1 (0.46) TOP1KMT2AMEN1KDM4EPKM
SCHEMBL1352152 0.87 MEN1 (0.43) TOP1KMT2AMEN1KDM4EPKM
SCHEMBL1349852 0.87 AKT1 (0.48) TOP1KMT2AMEN1KDM4EL3MBTL1
Quinoline SCHEMBL28117842 0.85 ALDH1A1 (0.55) TOP1KMT2AMEN1KDM4EPSMB5
SCHEMBL1351892 0.83 AKT1 (0.46) TOP1KMT2AMEN1KDM4EPKM
SCHEMBL30477086 0.81 PSMB5 (0.54) TOP1KMT2AMEN1KDM4EPSMB5
SCHEMBL2899383 0.81 TOP1 (0.50) TOP1KMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL28280373 0.81 FGFR1 (0.55) TOP1KMT2AMEN1KDM4EGAA
SCHEMBL1993651 0.81 TOP1 (0.50) TOP1KDM4EPKML3MBTL1AKT1

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-106083845-A A kind of 1,5 naphthyridine type luminous organic material compounds and synthetic method thereof and application 金陵科技学院 2016-11-09 CN disclosed