SCHEMBL29137767

SCHEMBL29137767

Brc1ccc2c(c1)c1cc(Br)ccc1c1cc3c(-c4ccccc4)nc(-c4ccccc4)nc3cc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WHR1 P49842 1/20 0.54
PRNP P04156 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.47
ATM Q13315 3/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
MAPT P10636 4/20 0.46
RXFP1 Q9HBX9 3/20 0.46
THRB P10828 1/20 0.46
POLB P06746 1/20 0.45
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
DCLK1 O15075 1/20 0.44
PRKD3 O94806 1/20 0.44
MAP4K4 O95819 1/20 0.44
CHEK2 O96017 1/20 0.44
CSF1R P07333 1/20 0.44
FER P16591 1/20 0.44
CDK2 P24941 1/20 0.44
MARK3 P27448 1/20 0.44

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
SCHEMBL18455642 0.89 PRNP (0.63) WHR1PRNPL3MBTL1ATMKMT2A
SCHEMBL18455539 0.88 KMT2A (0.55) WHR1PRNPL3MBTL1ATMKMT2A
SCHEMBL19320197 0.86 PRNP (0.60) WHR1PRNPL3MBTL1ATMKMT2A
SCHEMBL21174579 0.81 MEN1 (0.55) WHR1PRNPATMKMT2AMEN1
SCHEMBL18647353 0.80 PRNP (0.55) PRNPL3MBTL1ATMKMT2AMEN1
SCHEMBL21667432 0.78 MEN1 (0.59) WHR1PRNPATMKMT2AMEN1
SCHEMBL29191894 0.78 CYP1A1 (0.49) WHR1PRNPL3MBTL1ATMKMT2A
SCHEMBL30216158 0.78 CYP1A1 (0.49) WHR1PRNPL3MBTL1ATMKMT2A
SCHEMBL9889191 0.76 MEN1 (0.71) WHR1ATMKMT2AMEN1MAPT
SCHEMBL16211433 0.76 MEN1 (0.71) WHR1ATMKMT2AMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113402507-B Triphenylene derivative, light-emitting device material, and light-emitting device 浙江华显光电科技有限公司 2024-01-05 CN disclosed
CN-113402507-A Triphenylene derivative, light-emitting device material, and light-emitting device 浙江华显光电科技有限公司 2021-09-17 CN disclosed