SCHEMBL29419982

SCHEMBL29419982

Brc1c(Br)c2ccccc2c2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 1/20 0.42
POLB P06746 1/20 0.42
ALDH1A1 P00352 7/20 0.41
TDP1 Q9NUW8 2/20 0.41
HSD17B10 Q99714 3/20 0.39
CYP2A6 P11509 2/20 0.39
TSHR P16473 1/20 0.39
CYP1A2 P05177 4/20 0.38
THRB P10828 1/20 0.38
HPGD P15428 1/20 0.38
IDO1 P14902 1/20 0.37
CYP2C19 P33261 1/20 0.36
GPR3 P46089 3/20 0.35
MAPK1 P28482 2/20 0.33
KDM4E B2RXH2 2/20 0.33
PAX8 Q06710 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TRPM4 Q8TD43 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
SCHEMBL12627623 1.00 HPRT1 (0.42) HPRT1POLBALDH1A1TDP1HSD17B10
SCHEMBL5949863 0.92 POLB (0.42) HPRT1POLBALDH1A1TDP1HSD17B10
SCHEMBL30366469 0.92 POLB (0.42) HPRT1POLBALDH1A1TDP1HSD17B10
SCHEMBL29352635 0.88 ALDH1A1 (0.44) HPRT1POLBALDH1A1TDP1HSD17B10
SCHEMBL28511 0.88 ALDH1A1 (0.44) HPRT1POLBALDH1A1TDP1HSD17B10
SCHEMBL7915432 0.85 POLB (0.42) HPRT1POLBALDH1A1TDP1HSD17B10
SCHEMBL13418549 0.83 ALDH1A1 (0.46) HPRT1POLBALDH1A1TDP1HSD17B10
SCHEMBL17967021 0.81 ALDH1A1 (0.44) HPRT1POLBALDH1A1TDP1HSD17B10
SCHEMBL7240160 0.79 POLB (0.39) HPRT1POLBALDH1A1TDP1HSD17B10
SCHEMBL446563 0.79 POLB (0.39) HPRT1POLBALDH1A1TDP1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119064498-A Synchronous rapid detection method for 31 halogenated polycyclic aromatic hydrocarbons in complex cooked food matrix 广东工业大学 2024-12-03 CN claimed
CN-112851705-B Luminescent material for detecting 2,4, 6-trinitrophenol and preparation method thereof 亳州学院 2023-09-05 CN claimed
CN-114249685-A Ortho-diaryl substituted phenanthrene or phenanthroline carrier transport material and preparation method and application thereof 华南理工大学 2022-03-29 CN claimed
CN-122010982-A Polycyclic compound, light-emitting device, electronic device, and electronic apparatus 三星显示有限公司 2026-05-12 CN disclosed
CN-119064498-A Synchronous rapid detection method for 31 halogenated polycyclic aromatic hydrocarbons in complex cooked food matrix 广东工业大学 2024-12-03 CN disclosed
CN-114644638-B Nitrogen-containing heterocyclic compound and application thereof 广州华睿光电材料有限公司 2024-04-23 CN disclosed
CN-117120420-A Composition for organic optoelectronic device, and display device 三星SDI株式会社 2023-11-24 CN disclosed
CN-112851705-B Luminescent material for detecting 2,4, 6-trinitrophenol and preparation method thereof 亳州学院 2023-09-05 CN disclosed
CN-116635385-A Heterocyclic compound, organic light-emitting element comprising same, and organic layer composition for organic light-emitting element LT素材株式会社 2023-08-22 CN disclosed
CN-116491241-A Composition for organic optoelectronic device, and display device 三星SDI株式会社 2023-07-25 CN disclosed
CN-116116205-A Method for retarding generation of chloro-and bromo-polycyclic aromatic hydrocarbon by polycyclic aromatic hydrocarbon precursor 国科大杭州高等研究院 2023-05-16 CN disclosed
CN-110248922-B Novel phenanthrene compound and organic light-emitting element using same 株式会社LG化学 2022-10-14 CN disclosed
CN-114644638-A Nitrogen-containing heterocyclic compound and application thereof 广州华睿光电材料有限公司 2022-06-21 CN disclosed
CN-114249685-A Ortho-diaryl substituted phenanthrene or phenanthroline carrier transport material and preparation method and application thereof 华南理工大学 2022-03-29 CN disclosed