SCHEMBL28047900

SCHEMBL28047900

NC(=S)NN=C1c2ccccc2C(=O)c2c(O)ccc(O)c21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 9/20 0.59
▸ KMT2A Q03164 9/20 0.59
▸ GAA P10253 2/20 0.59
▸ MAPT P10636 7/20 0.54
▸ MAOA P21397 4/20 0.54
▸ TDP1 Q9NUW8 6/20 0.50
▸ MCL1 Q07820 5/20 0.50
▸ POLB P06746 3/20 0.50
▸ HPGD P15428 3/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ PABPC1 P11940 1/20 0.50
▸ CSNK1A1 P48729 1/20 0.50
▸ CSNK1D P48730 1/20 0.50
▸ BLM P54132 1/20 0.50
▸ PLEC Q15149 1/20 0.50
▸ CSNK1G1 Q9HCP0 1/20 0.50
▸ APEX1 P27695 2/20 0.42
▸ CASP6 P55212 1/20 0.42
▸ L3MBTL1 Q9Y468 5/20 0.42
▸ MAPK1 P28482 4/20 0.42

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
SCHEMBL27886286 0.81 MEN1 (0.48) MEN1KMT2AGAAMAPTMAOA
SCHEMBL14680498 0.79 MAPT (0.61) MEN1KMT2AMAPTMAOATDP1
SCHEMBL16210519 0.76 KMT2A (1.00) MEN1KMT2AGAAMAPTTDP1
Quinizarin SCHEMBL160038 0.74 MEN1 (1.00) MEN1KMT2AMAPTMAOATDP1
Quinizarin SCHEMBL29385801 0.74 MEN1 (1.00) MEN1KMT2AMAPTMAOATDP1
SCHEMBL3276060 0.74 MEN1 (0.63) MEN1KMT2AGAAMAPTTDP1
Quinizarin SCHEMBL25194269 0.72 MEN1 (0.95) MEN1KMT2AMAPTMAOATDP1
Quinizarin SCHEMBL30721500 0.72 MEN1 (0.95) MEN1KMT2AMAPTMAOATDP1
Quinizarin SCHEMBL29277729 0.72 MEN1 (0.95) MEN1KMT2AMAPTMAOATDP1
Quinizarin SCHEMBL11413119 0.72 MEN1 (0.95) MEN1KMT2AMAPTMAOATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105352920-A Method using 1,4-dihydroxy-9,10-anthraquinone thiosemicarbazone compound as fluorescent probe to detect copper ions UNIV HENAN NORMAL 2016-02-24 — — CN claimed
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