SCHEMBL29435255

SCHEMBL29435255

O=C(Br)/C=C(\C(=O)Br)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C1 Q04828 1/20 0.45
NFE2L2 Q16236 1/20 0.43
ALDH1A1 P00352 3/20 0.42
CES1 P23141 3/20 0.42
CES2 O00748 2/20 0.42
TSHR P16473 2/20 0.42
DAO P14920 1/20 0.42
NAPRT Q6XQN6 1/20 0.42
CA2 P00918 3/20 0.42
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA9 Q16790 2/20 0.42
TDP1 Q9NUW8 3/20 0.41
MAPK1 P28482 3/20 0.41
AKT1 P31749 1/20 0.40
PTPN1 P18031 1/20 0.40
GSK3B P49841 1/20 0.40
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
MAPT P10636 3/20 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
SCHEMBL10447305 0.75 AKT1 (0.47) AKR1C1NFE2L2ALDH1A1CES1CES2
SCHEMBL11394928 0.69 CES2 (0.68) ALDH1A1CES1CES2TSHRDAO
SCHEMBL165294 0.68 AKR1C1 (0.59) AKR1C1NFE2L2ALDH1A1CES1CES2
SCHEMBL11784531 0.68 AKR1C1 (0.59) AKR1C1NFE2L2ALDH1A1CES1CES2
SCHEMBL2919973 0.68 NFE2L2 (0.46) NFE2L2ALDH1A1CES1CES2TSHR
SCHEMBL31310306 0.68 NFE2L2 (0.64) NFE2L2ALDH1A1CES1CES2TSHR
SCHEMBL164580 0.68 AKR1C1 (0.59) AKR1C1NFE2L2ALDH1A1CES1CES2
SCHEMBL164579 0.68 AKR1C1 (0.59) AKR1C1NFE2L2ALDH1A1CES1CES2
SCHEMBL2477765 0.68
Benzene SCHEMBL27791154 0.68 CES1 (0.58) ALDH1A1CES1CES2TSHRDAO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115668547-A Cathode active material, cathode slurry and cathode for secondary battery 广东省皓智科技有限公司 2023-01-31 CN disclosed
CN-115668549-A Binder composition for secondary battery 广东省皓智科技有限公司 2023-01-31 CN disclosed
CN-115568289-A Cathode active material, cathode slurry and cathode for secondary battery 广东省皓智科技有限公司 2023-01-03 CN disclosed
CN-115336085-A Method for stripping composite 广东省皓智科技有限公司 2022-11-11 CN disclosed
CN-115053380-A Method for stripping composite 广东省皓智科技有限公司 2022-09-13 CN disclosed
CN-115053381-A Method for stripping composite 广东省皓智科技有限公司 2022-09-13 CN disclosed
CN-115023843-A Method for stripping composite 广东省皓智科技有限公司 2022-09-06 CN disclosed
CN-115023844-A Method for stripping composite 广东省皓智科技有限公司 2022-09-06 CN disclosed
CN-114868298-A Method for stripping composite 广东省皓智科技有限公司 2022-08-05 CN disclosed
CN-114846654-A Method for precipitating a polymer 广东省皓智科技有限公司 2022-08-02 CN disclosed
CN-114762145-A Slurry composition for flexible electrode in secondary battery 广东省皓智科技有限公司 2022-07-15 CN disclosed
CN-114503336-A Method for stripping composite 广东省皓智科技有限公司 2022-05-13 CN disclosed
CN-114424365-A Cathode for secondary battery and cathode slurry 广东省皓智科技有限公司 2022-04-29 CN disclosed
CN-114341304-A Binder composition for secondary battery 广东省皓智科技有限公司 2022-04-12 CN disclosed
CN-114342124-A Binder composition for secondary battery 广东省皓智科技有限公司 2022-04-12 CN disclosed
CN-114342125-A Binder composition for secondary battery 广东省皓智科技有限公司 2022-04-12 CN disclosed
CN-114287074-A Binder composition for secondary battery 广东省皓智科技有限公司 2022-04-05 CN disclosed