SCHEMBL29109596

SCHEMBL29109596

c1ccc2cc3cc4c([C]5CCC5)cccc4cc3cc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.38
KDM4E B2RXH2 2/20 0.38
GAA P10253 2/20 0.38
HSD17B10 Q99714 6/20 0.38
HIF1A Q16665 4/20 0.38
CASP1 P29466 3/20 0.38
TSHR P16473 3/20 0.38
MAPK1 P28482 3/20 0.38
HPGD P15428 3/20 0.38
CASP7 P55210 2/20 0.38
TP53 P04637 1/20 0.38
L3MBTL1 Q9Y468 4/20 0.37
CES1 P23141 1/20 0.36
CYP1B1 Q16678 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
MAPT P10636 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP1A2 P05177 2/20 0.33
ERBB2 P04626 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
SCHEMBL4723098 0.98 ALDH1A1 (0.39) ALDH1A1KDM4EGAAHSD17B10HIF1A
SCHEMBL29110070 0.96 ALDH1A1 (0.38) ALDH1A1KDM4EGAAHSD17B10HIF1A
SCHEMBL29109615 0.94 ALDH1A1 (0.37) ALDH1A1KDM4EGAAHSD17B10HIF1A
SCHEMBL4722083 0.94 ALDH1A1 (0.39) ALDH1A1KDM4EGAAHSD17B10HIF1A
SCHEMBL4721549 0.92 ALDH1A1 (0.38) ALDH1A1KDM4EGAAHSD17B10HIF1A
SCHEMBL29109616 0.92 ALDH1A1 (0.40) ALDH1A1KDM4EGAAHSD17B10HIF1A
SCHEMBL4723992 0.90 ALDH1A1 (0.41) ALDH1A1KDM4EGAAHSD17B10HIF1A
SCHEMBL29538643 0.81 ALDH1A1 (0.48) ALDH1A1KDM4EGAAHSD17B10HIF1A
SCHEMBL27506937 0.81 ALDH1A1 (0.48) ALDH1A1KDM4EGAAHSD17B10HIF1A
SCHEMBL4723266 0.79 NISCH (0.43) ALDH1A1KDM4EGAAHSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117903189-A Carbazole compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2024-04-19 CN claimed
CN-117903189-A Carbazole compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2024-04-19 CN disclosed
CN-117126149-A Heterocyclic compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2023-11-28 CN disclosed
CN-117088900-A Carbazole compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2023-11-21 CN disclosed
CN-117088889-A Carbazole compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2023-11-21 CN disclosed