SCHEMBL30451338

SCHEMBL30451338

c1ccc2c(c1)-c1ccccc1-c1cc(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)cc1-c1ccccc1-2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.48
KDM4E B2RXH2 3/20 0.48
ATM Q13315 1/20 0.48
ALDH1A1 P00352 4/20 0.46
GPR3 P46089 1/20 0.41
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
POLB P06746 1/20 0.39
DUSP3 P51452 1/20 0.39
CYP19A1 P11511 1/20 0.34
HPGD P15428 3/20 0.33
BACE1 P56817 2/20 0.33
HSD17B10 Q99714 2/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
CASP1 P29466 1/20 0.33
HIF1A Q16665 1/20 0.33
TUBB4A P04350 1/20 0.33
TUBB P07437 1/20 0.33
TUBA3C P0DPH7 1/20 0.33

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
SCHEMBL25223924 1.00 L3MBTL1 (0.48) L3MBTL1KDM4EATMALDH1A1GPR3
SCHEMBL20062675 0.94 L3MBTL1 (0.43) L3MBTL1KDM4EATMALDH1A1GPR3
SCHEMBL20062810 0.89 KDM4E (0.46) L3MBTL1KDM4EATMALDH1A1GPR3
SCHEMBL25227621 0.87 KDM4E (0.47) L3MBTL1KDM4EATMALDH1A1GPR3
SCHEMBL12258331 0.85 KDM4E (0.56) L3MBTL1KDM4EATMALDH1A1GPR3
SCHEMBL25638676 0.85 KDM4E (0.39) L3MBTL1KDM4EATMALDH1A1GPR3
SCHEMBL25638682 0.85 KDM4E (0.39) L3MBTL1KDM4EATMALDH1A1GPR3
SCHEMBL19075910 0.84 ALDH1A1 (0.52) L3MBTL1KDM4EATMALDH1A1GPR3
SCHEMBL64363 0.84 ALDH1A1 (0.52) L3MBTL1KDM4EATMALDH1A1GPR3
SCHEMBL12853961 0.84 ALDH1A1 (0.52) L3MBTL1KDM4EATMALDH1A1GPR3

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-116265439-A Organic electroluminescent material and device 环球展览公司 2023-06-20 CN disclosed