SCHEMBL12177928

SCHEMBL12177928

Nc1ccc(/N=N/c2ccc(/N=N/c3ccc(S(=O)(=O)O)cc3)c3cc(S(=O)(=O)O)ccc23)c2cccc(S(=O)(=O)O)c12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATIC P31939 2/20 0.60
▸ CYP2C9 P11712 1/20 0.59
▸ CYP2C19 P33261 1/20 0.59
▸ HSD17B10 Q99714 1/20 0.59
▸ SENP2 Q9HC62 6/20 0.59
▸ SENP3 Q9H4L4 5/20 0.59
▸ SENP1 Q9P0U3 5/20 0.59
▸ SUMO2 P61956 4/20 0.59
▸ SUMO1 P63165 4/20 0.59
▸ SENP7 Q9BQF6 4/20 0.59
▸ PHLPP2 Q6ZVD8 1/20 0.58
▸ SLC7A11 Q9UPY5 1/20 0.49
▸ CYP1A2 P05177 3/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ THRB P10828 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ ENPP2 Q13822 1/20 0.46
▸ GLO1 Q04760 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45

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
SCHEMBL12177945 1.00 ATIC (0.60) ATICCYP2C9CYP2C19HSD17B10SENP2
SCHEMBL12177925 0.94 SENP2 (0.63) ATICCYP2C9CYP2C19HSD17B10SENP2
SCHEMBL9178019 0.94 SENP2 (0.63) ATICCYP2C9CYP2C19HSD17B10SENP2
SCHEMBL12177970 0.93 ATIC (0.65) ATICCYP2C9CYP2C19HSD17B10SENP2
SCHEMBL12177912 0.92 SENP2 (0.69) ATICCYP2C9CYP2C19HSD17B10SENP2
SCHEMBL12177924 0.92 SENP2 (0.69) ATICCYP2C9CYP2C19HSD17B10SENP2
SCHEMBL9173981 0.92 SENP2 (0.58) ATICCYP2C9CYP2C19HSD17B10SENP2
SCHEMBL9177164 0.92 SENP2 (0.58) ATICCYP2C9CYP2C19HSD17B10SENP2
SCHEMBL9178611 0.91 SENP2 (0.57) ATICCYP2C9CYP2C19HSD17B10SENP2
SCHEMBL9178121 0.91 SENP2 (0.57) ATICCYP2C9CYP2C19HSD17B10SENP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2566941-B1 DYES AND BLENDS FOR SHADING DURING LAUNDRY BASF SE (DE) 2016-12-21 — — EP disclosed
US-20130247309-A1 DYES AND BLENDS FOR SHADING DURING LAUNDRY BASF SE (DE) 2013-09-26 — — US disclosed
US-20130247309-A1 DYES AND BLENDS FOR SHADING DURING LAUNDRY BASF SE (DE) 2013-09-26 — — US disclosed
WO-2011138183-A1 DYES AND BLENDS FOR SHADING DURING LAUNDRY BASF SE (DE) 2011-11-10 — — WO disclosed
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