SCHEMBL14546769

SCHEMBL14546769

Nc1ccc(/N=N/c2ccc(S(=O)(=O)CCOS(=O)(=O)O)cc2S(=O)(=O)O)c(O)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APEX1 P27695 1/20 0.36
▸ NSD2 O96028 3/20 0.36
▸ CASP6 P55212 3/20 0.36
▸ MMP14 P50281 2/20 0.36
▸ THRB P10828 1/20 0.36
▸ P2RX5 Q93086 2/20 0.36
▸ P2RX4 Q99571 2/20 0.36
▸ P2RX2 Q9UBL9 2/20 0.36
▸ NT5E P21589 2/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ATM Q13315 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
SCHEMBL14546749 0.90 TDP1 (0.36) APEX1THRBP2RX5P2RX4P2RX2
SCHEMBL13892263 0.88 NSD2 (0.48) NSD2CASP6MMP14THRBP2RX5
SCHEMBL14546744 0.88 P2RX5 (0.38) NSD2CASP6MMP14THRBP2RX5
SCHEMBL14546748 0.88 TP53 (0.40) APEX1NSD2CASP6MMP14THRB
SCHEMBL14546970 0.85 PHLPP2 (0.37) THRBP2RX5P2RX4P2RX2ALDH1A1
SCHEMBL14546921 0.83 NSD2 (0.37) NSD2CASP6MMP14THRBP2RX5
SCHEMBL14546913 0.83 THRB (0.42) APEX1NSD2CASP6MMP14THRB
SCHEMBL14546741 0.83 THRB (0.45) THRBP2RX5P2RX4P2RX2CYP1A2
SCHEMBL14546910 0.83 BRD4 (0.37) NSD2CASP6MMP14THRBP2RX5
SCHEMBL14546994 0.83 BRD4 (0.37) NSD2CASP6MMP14THRBP2RX5

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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