SCHEMBL8035550

SCHEMBL8035550

Nc1ccc(S(=O)(=O)O)c(N=Nc2c(S(=O)(=O)O)cc3cc(N)ccc3c2O)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHLPP2 Q6ZVD8 1/20 0.57
ENPP2 Q13822 5/20 0.48
CD40 P25942 1/20 0.47
CD40LG P29965 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
THRB P10828 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CYP1A2 P05177 3/20 0.46
NSD2 O96028 1/20 0.45
DUSP3 P51452 1/20 0.45
PTPN5 P54829 1/20 0.45
CASP6 P55212 1/20 0.45
PTPN11 Q06124 1/20 0.45
ALDH1A1 P00352 2/20 0.44
HIF1A Q16665 2/20 0.44
PRMT1 Q99873 2/20 0.43
PRMT3 O60678 1/20 0.43
EP300 Q09472 1/20 0.43
PRMT6 Q96LA8 1/20 0.43

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
SCHEMBL7770978 0.93 PHLPP2 (0.54) PHLPP2ENPP2CD40CD40LGMEN1
SCHEMBL10351775 0.93 MEN1 (0.56) PHLPP2ENPP2CD40CD40LGMEN1
SCHEMBL8070763 0.93 PHLPP2 (0.54) PHLPP2ENPP2CD40CD40LGMEN1
SCHEMBL10588141 0.91 ENPP2 (0.49) PHLPP2ENPP2CD40CD40LGMEN1
SCHEMBL7766620 0.90 PHLPP2 (0.61) PHLPP2ENPP2CD40CD40LGMEN1
SCHEMBL7591259 0.90 PHLPP2 (0.61) PHLPP2ENPP2CD40CD40LGMEN1
SCHEMBL10600174 0.90 PHLPP2 (0.60) PHLPP2ENPP2CD40CD40LGMEN1
SCHEMBL8904069 0.88 PHLPP2 (0.56) PHLPP2ENPP2CD40CD40LGMEN1
SCHEMBL8958917 0.88 PHLPP2 (0.56) PHLPP2ENPP2CD40CD40LGMEN1
SCHEMBL8779952 0.87 CD40 (0.56) PHLPP2ENPP2CD40CD40LGMEN1

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-0641839-B1 Fiber-reactive dyes, their preparation and application CIBA SC HOLDING AG (CH) 2000-05-24 EP claimed
EP-0131542-B1 REACTIVE DYES, THEIR PREPARATION AND THEIR USE CIBA-GEIGY AG (CH) 1989-04-19 EP disclosed
US-4818247-A COLORFASTNESS CIBA-GEIGY CORPORATION (US) 1989-04-04 US disclosed
EP-0131542-A1 Reactive dyes, their preparation and their use CIBA-GEIGY AG (CH) 1985-01-16 EP disclosed