SCHEMBL27804433

SCHEMBL27804433

CC(C)(C)C1CCC(c2c(S(N)(=O)=O)ccc3c2C(=O)c2cc(S(N)(=O)=O)ccc2C3=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 1/20 0.38
▸ NSD2 O96028 1/20 0.38
▸ HK1 P19367 1/20 0.38
▸ PAX8 Q06710 1/20 0.38
▸ GAA P10253 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ PARG Q86W56 5/20 0.34
▸ FTO Q9C0B1 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ PKM P14618 2/20 0.32
▸ POLB P06746 1/20 0.32
▸ CA1 P00915 5/20 0.32
▸ CA2 P00918 5/20 0.32
▸ CA9 Q16790 5/20 0.32
▸ CA12 O43570 4/20 0.32
▸ CA7 P43166 2/20 0.31
▸ CA14 Q9ULX7 2/20 0.31
▸ CDC25B P30305 1/20 0.31

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
SCHEMBL27804432 0.92 PARG (0.33) TDP2NSD2HK1PAX8GAA
SCHEMBL55489 0.85 TDP2 (0.35) TDP2NSD2HK1PAX8GAA
SCHEMBL55488 0.75 TDP2 (0.40) TDP2NSD2HK1PAX8GAA
SCHEMBL10775524 0.69 TDP2 (0.67) TDP2NSD2HK1PAX8GAA
SCHEMBL7339146 0.69 TDP2 (0.67) TDP2NSD2HK1PAX8GAA
SCHEMBL60256 0.68 PARG (0.72) MAPTPARGMEN1KMT2APKM
SCHEMBL28861105 0.67 SRC (0.42) TDP2NSD2HK1PAX8GAA
SCHEMBL27171469 0.66 PKM (0.40) TDP2NSD2HK1PAX8GAA
SCHEMBL29902406 0.66 PKM (0.62) TDP2NSD2HK1PAX8GAA
SCHEMBL6135419 0.65 TDP2 (0.61) TDP2NSD2HK1PAX8MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108314663-B Derivatives of fluorene, anthracene, xanthene, dibenzosuberone and acridine and uses thereof 多格伍德药品公司 2022-05-13 — — CN disclosed
CN-108314663-A The derivative and application thereof of fluorenes, anthracene, xanthene, Dibenzosuberone and acridine 多格伍德药品公司 2018-07-24 — — CN disclosed
CN-101730531-A derivatives of fluorene, anthracene, xanthene, dibenzosuberone and acridine and uses thereof AVALON PHARMACEUTICALS 2010-06-09 — — CN disclosed
Send feedback