SCHEMBL23637796

SCHEMBL23637796

O=Cc1ccc(-c2cc(-c3ccc(C=O)cc3)nc(-c3ccc(C=O)cc3)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
MAPT P10636 1/20 0.45
KIF11 P52732 1/20 0.42
DRD1 P21728 2/20 0.41
CYP19A1 P11511 1/20 0.41
MCL1 Q07820 3/20 0.41
CYP2A6 P11509 2/20 0.39
HSD17B10 Q99714 1/20 0.39
ALDH5A1 P51649 1/20 0.39
ABAT P80404 1/20 0.39
BRD4 O60885 1/20 0.38
ADORA3 P0DMS8 2/20 0.38
BRAF P15056 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CTRC Q99895 1/20 0.36
IP6K1 Q92551 1/20 0.36

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
SCHEMBL16381705 0.92 ALDH1A1 (0.55) ALDH1A1MAPTDRD1CYP19A1MCL1
SCHEMBL26091984 0.83 ALDH1A1 (0.57) ALDH1A1MAPTKIF11CYP2A6HSD17B10
SCHEMBL28511169 0.81 KIF11 (0.47) ALDH1A1KIF11DRD1CYP2A6HSD17B10
SCHEMBL4096252 0.81 CYP2A6 (0.50) ALDH1A1KIF11DRD1CYP2A6HSD17B10
SCHEMBL25249571 0.81 CYP2A6 (0.50) ALDH1A1KIF11DRD1CYP2A6HSD17B10
SCHEMBL29042272 0.80 MEN1 (0.52) ALDH1A1MAPTDRD1CYP2A6HSD17B10
SCHEMBL31099420 0.79 CCR1 (0.50) ALDH1A1MAPTCYP19A1CYP2A6HSD17B10
SCHEMBL976904 0.78 CYP2A6 (0.58) ALDH1A1KIF11DRD1CYP2A6HSD17B10
SCHEMBL25288128 0.78 CYP2A6 (0.58) ALDH1A1KIF11DRD1CYP2A6HSD17B10
SCHEMBL1666706 0.78 CYP2A6 (0.58) ALDH1A1KIF11DRD1CYP2A6HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118834344-A Covalent organic framework material and synthesis method thereof 四川大学 2024-10-25 CN claimed
CN-116239759-A Conjugated two-dimensional polymer film and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2023-06-09 CN claimed
CN-114761452-A Method for preparing hollow covalent organic framework material 浙江大学 2022-07-15 CN claimed
CN-118834344-A Covalent organic framework material and synthesis method thereof 四川大学 2024-10-25 CN disclosed
CN-118122381-A Preparation method and application of core-shell MOF@COF heterojunction material 中国科学院生态环境研究中心 2024-06-04 CN disclosed
CN-116239759-A Conjugated two-dimensional polymer film and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2023-06-09 CN disclosed
CN-114761452-A Method for preparing hollow covalent organic framework material 浙江大学 2022-07-15 CN disclosed
WO-2021142474-A1 COVALENT ORGANIC FRAMEWORKS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-07-15 WO disclosed