SCHEMBL30507752

SCHEMBL30507752

c1ccc(-n2c(-c3cccc(-c4nc5c6ccccc6c6ccccc6c5n4-c4ccccc4)c3)nc3c4ccccc4c4ccccc4c32)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
MAPT P10636 4/20 0.41
PI4KA P42356 1/20 0.41
PI4K2B Q8TCG2 1/20 0.41
PI4K2A Q9BTU6 1/20 0.41
PI4KB Q9UBF8 1/20 0.41
ALDH1A1 P00352 3/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 2/20 0.40
CYP2C19 P33261 1/20 0.40
RXFP1 Q9HBX9 2/20 0.40
OPRD1 P41143 2/20 0.40
HSD17B10 Q99714 1/20 0.40
OPRM1 P35372 1/20 0.40
HSP90AA1 P07900 1/20 0.38
THRB P10828 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL10296294 1.00 GAA (0.48) GAAMEN1KMT2AMAPTPI4KA
SCHEMBL14582723 0.94 MEN1 (0.43) GAAMEN1KMT2AMAPTPI4KA
SCHEMBL2631757 0.92 MEN1 (0.48) GAAMEN1KMT2AMAPTPI4KA
SCHEMBL14505950 0.89 GAA (0.41) GAAMEN1KMT2AMAPTPI4KA
SCHEMBL28576110 0.89 GAA (0.44) GAAMEN1KMT2AMAPTPI4KA
SCHEMBL27412118 0.88 KMT2A (0.50) GAAMEN1KMT2AMAPTALDH1A1
SCHEMBL18415798 0.88 MEN1 (0.39) GAAMEN1KMT2AMAPTALDH1A1
SCHEMBL14542814 0.87 OPRD1 (0.41) GAAMEN1KMT2AMAPTPI4KA
SCHEMBL14225139 0.87 MEN1 (0.40) GAAMEN1KMT2AMAPTPI4KA
SCHEMBL30507756 0.87 MEN1 (0.46) GAAMEN1KMT2AMAPTPI4KA

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-112928220-B Organic electroluminescent diode containing crystalline solid solution as light-emitting layer and application thereof 中国科学院长春应用化学研究所 2023-08-08 CN claimed