SCHEMBL28098173

SCHEMBL28098173

Brc1cccc(-c2cc(-c3cccc4c3[nH]c3ccccc34)cc(-c3cccc4c3[nH]c3ccccc34)c2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDO2 P48775 4/20 0.59
▸ IDO1 P14902 1/20 0.59
▸ AR P10275 1/20 0.43
▸ KIF11 P52732 3/20 0.42
▸ HTR6 P50406 1/20 0.42
▸ CAMK2D Q13557 1/20 0.41
▸ PARP14 Q460N5 6/20 0.41
▸ HTR2B P41595 1/20 0.40
▸ HTR5A P47898 1/20 0.40
▸ EGFR P00533 1/20 0.40
▸ BCHE P06276 1/20 0.40
▸ CDK4 P11802 2/20 0.39
▸ CCND1 P24385 2/20 0.39
▸ CCNB2 O95067 1/20 0.39
▸ CCNE2 O96020 1/20 0.39
▸ CDK1 P06493 1/20 0.39
▸ CCNB1 P14635 1/20 0.39
▸ CCNE1 P24864 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ CCNB3 Q8WWL7 1/20 0.39

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
SCHEMBL27916148 0.93 TDO2 (0.60) TDO2IDO1ARKIF11HTR6
SCHEMBL1193029 0.92 TDO2 (0.63) TDO2IDO1ARKIF11HTR6
SCHEMBL5929597 0.91 IDO1 (0.54) TDO2IDO1ARKIF11PARP14
SCHEMBL2781496 0.88 IDO1 (0.48) TDO2IDO1ARKIF11CAMK2D
SCHEMBL2819507 0.88 KIF11 (0.50) TDO2IDO1KIF11PARP14HTR2B
SCHEMBL6069280 0.87 KIF11 (0.53) TDO2KIF11PARP14HTR2BHTR5A
SCHEMBL867558 0.86 KIF11 (0.52) TDO2IDO1KIF11PARP14HTR2B
SCHEMBL30950767 0.86 KIF11 (0.52) TDO2IDO1KIF11PARP14HTR2B
SCHEMBL29935623 0.86 KIF11 (0.55) TDO2KIF11PARP14HTR2BHTR5A
SCHEMBL415890 0.86 KIF11 (0.55) TDO2KIF11PARP14HTR2BHTR5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106167463-A Aromatic amine compounds and preparation method thereof and the organic luminescent device being made up of this compound 吉林奥来德光电材料股份有限公司 2016-11-30 — — CN claimed
CN-105968041-A Biphenyl dicarbazyl compound and preparation method thereof and organic luminescent device prepared from same 吉林奥来德光电材料股份有限公司 2016-09-28 — — CN claimed
CN-106167463-A Aromatic amine compounds and preparation method thereof and the organic luminescent device being made up of this compound 吉林奥来德光电材料股份有限公司 2016-11-30 — — CN disclosed
CN-105968041-A Biphenyl dicarbazyl compound and preparation method thereof and organic luminescent device prepared from same 吉林奥来德光电材料股份有限公司 2016-09-28 — — CN disclosed
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