SCHEMBL14547032

SCHEMBL14547032

COc1ccc(S(=O)(=O)CCOS(=O)(=O)O)cc1/N=N/c1cc(/N=N/c2ccc(S(=O)(=O)CCOS(=O)(=O)O)cc2S(=O)(=O)O)c(O)cc1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 5/20 0.45
▸ KDM4E B2RXH2 4/20 0.45
▸ MAPT P10636 4/20 0.45
▸ RAB9A P51151 3/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ HTT P42858 2/20 0.45
▸ PRMT1 Q99873 1/20 0.44
▸ MAPK1 P28482 2/20 0.37
▸ MITF O75030 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ PAX8 Q06710 1/20 0.37
▸ PHLPP2 Q6ZVD8 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.35
▸ P2RX5 Q93086 2/20 0.35
▸ P2RX4 Q99571 2/20 0.35
▸ P2RX2 Q9UBL9 2/20 0.35
▸ CASP1 P29466 1/20 0.35

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
SCHEMBL14546750 0.93 KDM4E (0.42) TDP1KDM4EMAPTRAB9AMEN1
SCHEMBL14546744 0.90 P2RX5 (0.38) TDP1KDM4EMAPTRAB9AMEN1
SCHEMBL14547034 0.90 PRMT1 (0.46) TDP1KDM4EMAPTRAB9AMEN1
SCHEMBL14546906 0.89 KDM4E (0.40) TDP1KDM4EMAPTRAB9AMEN1
SCHEMBL14546780 0.87 PRMT1 (0.42) TDP1KDM4EMAPTRAB9AMEN1
SCHEMBL14547008 0.87 MAPT (0.43) TDP1KDM4EMAPTRAB9AMEN1
SCHEMBL12053223 0.86 KDM4E (0.41) TDP1KDM4EMAPTRAB9AMEN1
SCHEMBL14546986 0.85 PRMT1 (0.43) TDP1KDM4EMAPTRAB9AMEN1
SCHEMBL14546921 0.85 NSD2 (0.37) TDP1KDM4EMAPTRAB9AMEN1
SCHEMBL14546913 0.85 THRB (0.42) TDP1KDM4EMAPTRAB9AMEN1

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
WO-2007039573-A2 AZO REACTIVE DYES AND MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PREPARATION AND THEIR USE DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 2007-04-12 — — WO disclosed
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