SCHEMBL30828478

SCHEMBL30828478

COc1ccc(C2C=Cc3c(ccc4ccccc34)C2)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.47
MAPT P10636 1/20 0.40
MYB P10242 1/20 0.40
ABCB1 P08183 1/20 0.40
ABCC1 P33527 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
PTAFR P25105 1/20 0.40
NR3C1 P04150 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL29200225 1.00 PKM (0.47) PKMMAPTMYBABCB1ABCC1
SCHEMBL28182409 0.84 KDM4E (0.39) PKMMAPTMYBABCB1ABCC1
SCHEMBL29372523 0.77 ANPEP (0.35) MEN1KMT2A
SCHEMBL28682877 0.77 ANPEP (0.35) MEN1KMT2A
SCHEMBL30387904 0.73 HTR2C (0.37)
SCHEMBL30937761 0.71 LTA4H (0.39) MAPT
SCHEMBL30937763 0.71 LTA4H (0.39) MAPT
SCHEMBL30828480 0.71 MYB (0.44) PKMMAPTMYBABCB1ABCC1
SCHEMBL29679308 0.71 LPL (0.42)
SCHEMBL27884892 0.68 PKM (0.44) PKMMAPTMYBABCB1ABCC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117717917-A Dopamine/methoxy covalent organic framework membrane for organic dye separation and preparation method and application thereof 齐齐哈尔大学 2024-03-19 CN claimed
CN-117717917-A Dopamine/methoxy covalent organic framework membrane for organic dye separation and preparation method and application thereof 齐齐哈尔大学 2024-03-19 CN disclosed