SCHEMBL22413386

SCHEMBL22413386

O=C(O)c1cc(O)c(N=Nc2cccc(S(=O)(=O)CCOS(=O)(=O)O)c2)c(O)c1N=Nc1ccc(S(=O)(=O)CCOS(=O)(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GLO1 Q04760 4/20 0.46
▸ PHLPP2 Q6ZVD8 4/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ CYP2C9 P11712 2/20 0.41
▸ PTGS2 P35354 2/20 0.41
▸ PTGS1 P23219 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ THRB P10828 1/20 0.40
▸ CA2 P00918 6/20 0.40
▸ CA12 O43570 5/20 0.40
▸ CA9 Q16790 5/20 0.40
▸ KMT2A Q03164 4/20 0.39
▸ MAPT P10636 3/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ USP2 O75604 2/20 0.39
▸ POLB P06746 2/20 0.39
▸ MAPK1 P28482 2/20 0.37
▸ GAA P10253 1/20 0.37
▸ BLVRB P30043 2/20 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
SCHEMBL22413384 1.00 GLO1 (0.46) GLO1PHLPP2ALDH1A1CYP2C9PTGS2
SCHEMBL22413418 0.97 GLO1 (0.48) GLO1PHLPP2ALDH1A1CYP2C9PTGS2
SCHEMBL22413422 0.93 THRB (0.45) GLO1PHLPP2ALDH1A1CYP2C9PTGS2
SCHEMBL22256262 0.89 PHLPP2 (0.39) GLO1PHLPP2ALDH1A1CYP2C9PTGS2
SCHEMBL22256369 0.87 GLO1 (0.39) GLO1PHLPP2ALDH1A1THRBCA2
SCHEMBL22256305 0.87 MEN1 (0.45) GLO1PHLPP2ALDH1A1CYP2C9PTGS2
SCHEMBL22413443 0.86 THRB (0.40) GLO1PHLPP2ALDH1A1CYP2C9PTGS2
SCHEMBL22256302 0.86 PHLPP2 (0.45) PHLPP2ALDH1A1CYP2C9PTGS2PTGS1
SCHEMBL22411683 0.86 PHLPP2 (0.45) PHLPP2ALDH1A1CYP2C9PTGS2PTGS1
SCHEMBL22413435 0.86 PHLPP2 (0.45) PHLPP2ALDH1A1CYP2C9PTGS2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10954392-B2 Reactive navy to black dye composition and dye product thereof ZHEJIANG KEYONG CHEMICAL CO., LTD. (CN) 2021-03-23 — — US disclosed
US-20200283634-A1 A REACTIVE NAVY TO BLACK DYE COMPOSITION AND DYE PRODUCT THEREOF Shanghai Kehua dyestuff Industry Co., Ltd. (CN) 2020-09-10 — — US disclosed
Send feedback