SCHEMBL28640907

SCHEMBL28640907

c1ccc(-n2c3cc4c(cc3c3cc5[nH]c6ccccc6c5cc32)[nH]c2ccccc24)cc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.62
ALDH1A1 P00352 2/20 0.48
HSD17B10 Q99714 2/20 0.48
GPR3 P46089 1/20 0.48
PDE7A Q13946 2/20 0.47
PDE7B Q9NP56 2/20 0.47
KDM4E B2RXH2 3/20 0.47
ATM Q13315 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KIF11 P52732 11/20 0.45
TOP2A P11388 1/20 0.43
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL31652 0.95 KDM4E (0.56) AHRALDH1A1HSD17B10GPR3PDE7A
SCHEMBL29402271 0.95 KDM4E (0.56) AHRALDH1A1HSD17B10GPR3PDE7A
SCHEMBL27429862 0.93 AHR (0.57) AHRALDH1A1HSD17B10GPR3PDE7A
SCHEMBL16940915 0.92 AHR (0.52) AHRALDH1A1HSD17B10GPR3PDE7A
SCHEMBL13466760 0.89 KDM4E (0.56) AHRALDH1A1HSD17B10GPR3PDE7A
SCHEMBL29819577 0.89 KDM4E (0.56) AHRALDH1A1HSD17B10GPR3PDE7A
SCHEMBL29431053 0.89 KDM4E (0.56) AHRALDH1A1HSD17B10GPR3PDE7A
SCHEMBL15749793 0.89 AHR (0.49) AHRALDH1A1HSD17B10GPR3PDE7A
SCHEMBL28641081 0.87 AHR (0.55) AHRALDH1A1HSD17B10GPR3KDM4E
SCHEMBL23598379 0.87 AHR (0.50) AHRALDH1A1HSD17B10GPR3PDE7A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113563871-B Host material, organic photoelectric device and display or lighting device 浙江华显光电科技有限公司 2022-01-11 CN disclosed
CN-113563871-A Host material, organic photoelectric device and display or lighting device 浙江华显光电科技有限公司 2021-10-29 CN disclosed
CN-113444097-A Tri-carbazole derivative, organic photoelectric device, and display or lighting device 浙江华显光电科技有限公司 2021-09-28 CN disclosed