SCHEMBL28532001

SCHEMBL28532001

Cn1c2ccccc2c2cc(N)cc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)c21

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.35
GPR3 P46089 1/20 0.34
ALKBH5 Q6P6C2 1/20 0.34
FTO Q9C0B1 1/20 0.34
HSP90AA1 P07900 1/20 0.34
IDO1 P14902 1/20 0.34
PDK2 Q15119 2/20 0.33
LIMK1 P53667 1/20 0.33
BRD4 O60885 2/20 0.32
PABPC1 P11940 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
TLR9 Q9NR96 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
HSD17B10 Q99714 1/20 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
SCHEMBL30586165 1.00 L3MBTL1 (0.35) L3MBTL1GPR3ALKBH5FTOHSP90AA1
SCHEMBL18565365 0.87 ALKBH5 (0.44) L3MBTL1GPR3ALKBH5FTOHSP90AA1
SCHEMBL15870960 0.79 PDK2 (0.36) PDK2
SCHEMBL18565372 0.79 RXRA (0.50) L3MBTL1GPR3HSP90AA1IDO1PDK2
SCHEMBL13433076 0.79 GPR3 (0.44) L3MBTL1GPR3PDK2PABPC1MEN1
SCHEMBL22707124 0.78 ALKBH5 (0.39) L3MBTL1GPR3ALKBH5FTOHSP90AA1
SCHEMBL18565376 0.77 GPR3 (0.39) L3MBTL1GPR3PDK2PABPC1MEN1
SCHEMBL12865686 0.77 RXRA (0.48) L3MBTL1GPR3HSP90AA1IDO1PDK2
SCHEMBL27673154 0.76 RET (0.50) L3MBTL1GPR3ALKBH5FTOHSP90AA1
SCHEMBL16755468 0.76 HPRT1 (0.39) PDK2HSD17B10

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-112500326-A Hole transport/exciton blocking material with high triplet state energy level and high glass transition temperature, preparation and application 华南理工大学 2021-03-16 CN disclosed