SCHEMBL9844573

SCHEMBL9844573

Cc1cc(C)c(S(=O)(=O)O)c(C)c1Nc1cc(S(=O)(=O)O)c(N)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GNG2 P59768 5/20 0.61
GNB1 P62873 5/20 0.61
ALDH1A1 P00352 3/20 0.60
HPGD P15428 3/20 0.60
MAPK1 P28482 3/20 0.60
P2RY1 P47900 3/20 0.60
MEN1 O00255 2/20 0.60
NSD2 O96028 2/20 0.60
POLB P06746 2/20 0.60
MAPT P10636 2/20 0.60
THRB P10828 2/20 0.60
RECQL P46063 2/20 0.60
KMT2A Q03164 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
NPSR1 Q6W5P4 2/20 0.60
TDP1 Q9NUW8 2/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
PHLPP2 Q6ZVD8 2/20 0.58
P2RY4 P51582 8/20 0.56
CYP1A2 P05177 2/20 0.55

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
SCHEMBL30371545 0.99 GNG2 (0.60) GNG2GNB1ALDH1A1HPGDMAPK1
SCHEMBL30876547 0.92 P2RY1 (0.72) ALDH1A1HPGDMAPK1P2RY1MEN1
SCHEMBL13214108 0.91 GNG2 (0.64) GNG2GNB1ALDH1A1HPGDMAPK1
SCHEMBL8021024 0.89 GNG2 (0.64) GNG2GNB1ALDH1A1HPGDMAPK1
SCHEMBL14355357 0.88 GNG2 (0.62) GNG2GNB1ALDH1A1HPGDMAPK1
SCHEMBL11333865 0.86 ALDH1A1 (0.79) GNG2GNB1ALDH1A1HPGDMAPK1
SCHEMBL8947711 0.86 MAPK1 (0.46) GNG2GNB1ALDH1A1HPGDMAPK1
SCHEMBL3028166 0.85 ALDH1A1 (0.77) GNG2GNB1ALDH1A1HPGDMAPK1
SCHEMBL30205040 0.85 ALDH1A1 (0.77) GNG2GNB1ALDH1A1HPGDMAPK1
SCHEMBL8630004 0.84 GNG2 (0.66) GNG2GNB1ALDH1A1HPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2546309-B1 ANTHRAPYRIDONE SULPHONIC ACID COMPOUNDS, PREPARATION AND USE THEREOF UNIV DALIAN TECH (CN) 2016-06-01 EP disclosed
US-8968453-B2 Anthrapyridone sulfonic acid compounds and their preparation methods and applications Zhuhai Ninestar Management Co., Ltd. (CN) 2015-03-03 US disclosed
US-8968453-B2 Anthrapyridone sulfonic acid compounds and their preparation methods and applications Zhuhai Ninestar Management Co., Ltd. (CN) 2015-03-03 US disclosed
EP-2546309-A1 ANTHRAPYRIDONE SULPHONIC ACID COMPOUNDS, PREPARATION AND USE THEREOF Dalian University Of Technology (CN) 2013-01-16 EP disclosed
EP-0433764-A1 Reactive dyestuffs with triazin- and chlorobutinyl anchor BASF Aktiengesellschaft (DE) 1991-06-26 EP disclosed