SCHEMBL29200844

SCHEMBL29200844

Cc1cccc2c1ccc(=O)n2Cc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.70
MEN1 O00255 2/20 0.70
ATM Q13315 1/20 0.55
P2RX4 Q99571 2/20 0.54
MAPT P10636 4/20 0.54
KDM4E B2RXH2 4/20 0.54
ALDH1A1 P00352 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MAPK1 P28482 1/20 0.54
CYP19A1 P11511 1/20 0.51
LMNA P02545 2/20 0.50
GAA P10253 2/20 0.49
HSD17B10 Q99714 1/20 0.49
C5AR1 P21730 1/20 0.48
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
PGR P06401 1/20 0.46
THRB P10828 1/20 0.45

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
SCHEMBL30783430 1.00 KMT2A (0.70) KMT2AMEN1ATMP2RX4MAPT
SCHEMBL30783416 0.83 MEN1 (1.00) KMT2AMEN1ATMP2RX4MAPT
SCHEMBL377486 0.83 MEN1 (1.00) KMT2AMEN1ATMP2RX4MAPT
SCHEMBL30783426 0.81 KMT2A (0.61) KMT2AMEN1ATMP2RX4MAPT
SCHEMBL29200808 0.81 KMT2A (0.61) KMT2AMEN1ATMP2RX4MAPT
SCHEMBL29200848 0.80 MAPK14 (0.59) KMT2AMEN1P2RX4MAPTKDM4E
SCHEMBL30783435 0.80 MAPK14 (0.59) KMT2AMEN1P2RX4MAPTKDM4E
SCHEMBL14529788 0.78 SMN1; SMN2 (0.65) KMT2AMEN1ATMP2RX4MAPT
SCHEMBL4096894 0.77 KDM4E (0.43) KMT2AMEN1ATMKDM4EALDH1A1
SCHEMBL29200792 0.77 KMT2A (0.56) KMT2AMEN1ATMP2RX4MAPT

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-117624043-A Preparation method of quinolinone compound 安徽中医药大学 2024-03-01 CN disclosed