SCHEMBL29878552

SCHEMBL29878552

COc1cc(Br)c(Br)cc1OC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
PRKDC P78527 1/20 0.58
LCK P06239 1/20 0.56
FYN P06241 1/20 0.56
MAPT P10636 2/20 0.54
NPSR1 Q6W5P4 1/20 0.54
ALOX5 P09917 1/20 0.48
PTGS2 P35354 1/20 0.48
CYP3A4 P08684 1/20 0.48
HTR2A P28223 6/20 0.46
TAAR1 Q96RJ0 3/20 0.46
HTR2C P28335 2/20 0.46
ACHE P22303 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43

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
SCHEMBL369991 1.00 POLB (0.67) POLBL3MBTL1PRKDCLCKFYN
SCHEMBL580565 0.88 POLB (0.54) POLBL3MBTL1PRKDCLCKFYN
SCHEMBL28799442 0.88 POLB (0.61) POLBL3MBTL1MAPTNPSR1HTR2A
SCHEMBL30202128 0.88 POLB (0.54) POLBL3MBTL1PRKDCLCKFYN
SCHEMBL298224 0.87 POLB (0.59) POLBL3MBTL1PRKDCMAPTNPSR1
SCHEMBL27143368 0.85 POLB (0.52) POLBL3MBTL1PRKDCLCKFYN
SCHEMBL1505362 0.83 MAPT (0.52) POLBL3MBTL1PRKDCLCKFYN
SCHEMBL16167828 0.83 L3MBTL1 (0.56) POLBL3MBTL1PRKDCLCKFYN
SCHEMBL13517864 0.83 L3MBTL1 (0.50) POLBL3MBTL1PRKDCLCKFYN
SCHEMBL30010118 0.83 PRKDC (0.50) POLBL3MBTL1PRKDCLCKFYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115785466-B Preparation method and application of supermolecular material with green photooxidation effect 广州大学 2023-08-08 CN claimed
CN-115785466-A Preparation method and application of supramolecular material with green light oxidation effect 广州大学 2023-03-14 CN claimed
CN-114981275-B Tricyclic compound, preparation method and medical application thereof 中国医药研究开发中心有限公司 2023-12-19 CN disclosed
CN-115785466-B Preparation method and application of supermolecular material with green photooxidation effect 广州大学 2023-08-08 CN disclosed
CN-115216024-B Metal organic coordination supermolecule ball and preparation method thereof 黔南民族师范学院 2023-07-18 CN disclosed
CN-115785466-A Preparation method and application of supramolecular material with green light oxidation effect 广州大学 2023-03-14 CN disclosed
CN-115433227-A Multidentate phosphine coordinated copper trihalo tri-type complex, and synthesis method and application thereof 黑龙江大学 2022-12-06 CN disclosed
CN-115216024-A Metal organic coordination supermolecule sphere and preparation method thereof 黔南民族师范学院 2022-10-21 CN disclosed
CN-114981275-A Tricyclic compound, preparation method and medical application thereof 中国医药研究开发中心有限公司 2022-08-30 CN disclosed