SCHEMBL9293198

SCHEMBL9293198

NCCNc1c(S(=O)(=O)O)ccc2ccc(S(=O)(=O)O)cc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP6 P55212 4/20 0.47
▸ CYP2C9 P11712 4/20 0.47
▸ CYP2C19 P33261 4/20 0.47
▸ HSD17B10 Q99714 4/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ NT5E P21589 2/20 0.38
▸ SNCA P37840 2/20 0.35
▸ NSD2 O96028 3/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ DUSP3 P51452 2/20 0.34
▸ PTPN5 P54829 2/20 0.34
▸ PTPN11 Q06124 2/20 0.34
▸ THRB P10828 1/20 0.34
▸ APEX1 P27695 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ CASP7 P55210 1/20 0.34
▸ CYP1A2 P05177 3/20 0.34

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
SCHEMBL10584051 0.75 SNCA (0.54) CASP6CYP2C9CYP2C19HSD17B10ALDH1A1
SCHEMBL10585258 0.74 SNCA (0.49) CASP6CYP2C9CYP2C19HSD17B10ALDH1A1
SCHEMBL31635713 0.72 ALDH1A1 (0.62) CASP6CYP2C9CYP2C19HSD17B10ALDH1A1
SCHEMBL1755223 0.72 ALDH1A1 (0.62) CASP6CYP2C9CYP2C19HSD17B10ALDH1A1
SCHEMBL30585296 0.72 ALDH1A1 (0.62) CASP6CYP2C9CYP2C19HSD17B10ALDH1A1
SCHEMBL30639251 0.72 ALDH1A1 (0.62) CASP6CYP2C9CYP2C19HSD17B10ALDH1A1
SCHEMBL3009308 0.72 CASP6 (0.59) CASP6CYP2C9CYP2C19HSD17B10ALDH1A1
SCHEMBL15836276 0.72 CA1 (0.45) APEX1SMN1; SMN2CA12CA3CA4
SCHEMBL27999033 0.72 ALDH1A1 (0.56) CASP6CYP2C9CYP2C19HSD17B10ALDH1A1
SCHEMBL10580903 0.71 NT5E (0.64) CASP6CYP2C9CYP2C19HSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0515379-A4 ELECTRO-BLOTTING OF ELECTROPHORETICALLY RESOLVED FLUORESCENT-LABELED SACCHARIDES AND DETECTION OF ACTIVE STRUCTURES WITH PROTEIN PROBES GLYCOMED INC (US) 1994-09-14 — — EP claimed
EP-0515379-A1 ELECTRO-BLOTTING OF ELECTROPHORETICALLY RESOLVED FLUORESCENT-LABELED SACCHARIDES AND DETECTION OF ACTIVE STRUCTURES WITH PROTEIN PROBES GLYCOMED INCORPORATED (US) 1992-12-02 — — EP claimed
US-5094740-A TWO-DIMENSIONAL ELECTROPHORETIC SEPARATION OF CARBOHYDRATES GLYCOMED, INC. (US) 1992-03-10 — — US claimed
WO-1991012276-A1 ELECTRO-BLOTTING OF ELECTROPHORETICALLY RESOLVED FLUORESCENT-LABELED SACCHARIDES AND DETECTION OF ACTIVE STRUCTURES WITH PROTEIN PROBES GLYCOMED INCORPORATED (US) 1991-08-22 — — WO claimed
WO-1991012275-A1 TWO-DIMENSIONAL ELECTROPHORETIC SEPARATION OF CARBOHYDRATES GLYCOMED INCORPORATED (US) 1991-08-22 — — WO claimed
US-5094740-A TWO-DIMENSIONAL ELECTROPHORETIC SEPARATION OF CARBOHYDRATES GLYCOMED, INC. (US) 1992-03-10 — — US disclosed
US-5087337-A FLUORESCENT TAG FOR SUGAR ELECTROPHORESIS GLYCOMED, INC. (US) 1992-02-11 — — US disclosed
WO-1991012520-A1 FLUORESCENT TAG FOR SUGAR ELECTROPHORESIS GLYCOMED INCORPORATED (US) 1991-08-22 — — WO disclosed
WO-1991012275-A1 TWO-DIMENSIONAL ELECTROPHORETIC SEPARATION OF CARBOHYDRATES GLYCOMED INCORPORATED (US) 1991-08-22 — — WO disclosed
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