SCHEMBL25249571

SCHEMBL25249571

O=Cc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc(C=O)cc5)cc4)cc(-c4ccc(-c5ccc(C=O)cc5)cc4)c3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 4/20 0.50
DRD1 P21728 2/20 0.50
KIF11 P52732 1/20 0.50
HSD17B10 Q99714 1/20 0.50
ALDH5A1 P51649 1/20 0.50
ABAT P80404 1/20 0.50
ALDH1A1 P00352 6/20 0.48
KDM4E B2RXH2 2/20 0.44
TYR P14679 1/20 0.44
PTGS2 P35354 1/20 0.44
RAB9A P51151 1/20 0.44
CYP2A13 Q16696 1/20 0.44
ESR1 P03372 1/20 0.41
ALDH3A1 P30838 1/20 0.41
ALDH1A3 P47895 1/20 0.41
TRIM24 O15164 1/20 0.41
TRIM33 Q9UPN9 1/20 0.41
BRD4 O60885 1/20 0.41

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
SCHEMBL4096252 1.00 CYP2A6 (0.50) CYP2A6DRD1KIF11HSD17B10ALDH5A1
SCHEMBL27335985 0.91 CYP2A6 (0.58) CYP2A6DRD1KIF11HSD17B10ALDH5A1
SCHEMBL976904 0.91 CYP2A6 (0.58) CYP2A6DRD1KIF11HSD17B10ALDH5A1
SCHEMBL25288128 0.91 CYP2A6 (0.58) CYP2A6DRD1KIF11HSD17B10ALDH5A1
SCHEMBL1666706 0.91 CYP2A6 (0.58) CYP2A6DRD1KIF11HSD17B10ALDH5A1
SCHEMBL16381738 0.90 ALDH1A1 (0.59) CYP2A6DRD1KIF11HSD17B10ALDH5A1
SCHEMBL28511169 0.89 KIF11 (0.47) CYP2A6DRD1KIF11HSD17B10ALDH5A1
SCHEMBL13707875 0.88 CYP2A6 (0.73) CYP2A6DRD1KIF11HSD17B10ALDH5A1
SCHEMBL26071511 0.88 ALDH1A1 (0.45) CYP2A6DRD1KIF11HSD17B10ALDH5A1
Hydrochloric Acid SCHEMBL7799271 0.88 CYP2A6 (0.55) CYP2A6DRD1KIF11HSD17B10ALDH5A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023124952-A1 GREEN SOLID-PHASE SYNTHESIS METHOD FOR COVALENT ORGANIC FRAMEWORK MATERIAL 张振杰 2023-07-06 WO claimed
CN-115057981-B Amino-functionalized covalent organic framework material and preparation method and application thereof 北京市疾病预防控制中心 2022-11-15 CN claimed
CN-115057981-A Amino-functionalized covalent organic framework material and preparation method and application thereof 北京市疾病预防控制中心 2022-09-16 CN claimed
CN-113912805-A Organic porous polymer for catalyzing cycloaddition of epoxide and carbon dioxide 福州大学 2022-01-11 CN claimed
WO-2023124952-A1 GREEN SOLID-PHASE SYNTHESIS METHOD FOR COVALENT ORGANIC FRAMEWORK MATERIAL 张振杰 2023-07-06 WO disclosed
CN-114940744-B Optical response sp 2 Carbon covalent organic framework material and preparation method thereof 东北大学 2023-03-10 CN disclosed
CN-114940744-A Optical response sp 2 Carbon covalent organic framework material and preparation method thereof 东北大学 2022-08-26 CN disclosed
CN-114773556-A Green solid-phase synthesis method of covalent organic framework material 南开大学 2022-07-22 CN disclosed
CN-114761452-A Method for preparing hollow covalent organic framework material 浙江大学 2022-07-15 CN disclosed
WO-2022061666-A1 METHOD FOR PREPARING HOLLOW COVALENT ORGANIC FRAMEWORK MATERIAL 浙江大学 2022-03-31 WO disclosed
CN-113912805-A Organic porous polymer for catalyzing cycloaddition of epoxide and carbon dioxide 福州大学 2022-01-11 CN disclosed
CN-112156758-B Porous material and preparation method and application thereof 清华大学 2021-08-31 CN disclosed
CN-213951059-U Reaction device for preparing covalent organic framework through photo-initiation under vacuum condition 江阴创优新材料科技有限公司 2021-08-13 CN disclosed
CN-213611314-U Reaction device of covalent organic framework composite material based on photoinitiation 江阴创优新材料科技有限公司 2021-07-06 CN disclosed
CN-213160718-U Device based on continuous distillation preparation is covalence organic frame 苏州希夫安材料科技有限公司 2021-05-11 CN disclosed
CN-213160715-U Preparation facilities based on covalent organic skeleton of crystal multi-stage screening 苏州希夫安材料科技有限公司 2021-05-11 CN disclosed
CN-213160716-U Preparation facilities of high crystallinity covalence organic frame 苏州希夫安材料科技有限公司 2021-05-11 CN disclosed
CN-212893929-U Reaction device for preparing porous nano carbon material based on COFs material 苏州希夫安材料科技有限公司 2021-04-06 CN disclosed
CN-112156758-A Porous material and preparation method and application thereof 清华大学 2021-01-01 CN disclosed