SCHEMBL22413422

SCHEMBL22413422

O=C(O)c1cc(O)c(N=Nc2ccc(S(=O)(=O)CCOS(=O)(=O)O)cc2)c(O)c1N=Nc1ccc(S(=O)(=O)CCOS(=O)(=O)O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 2/20 0.45
▸ PHLPP2 Q6ZVD8 6/20 0.43
▸ PTGS2 P35354 4/20 0.43
▸ ALDH1A1 P00352 4/20 0.43
▸ HSD17B10 Q99714 3/20 0.43
▸ CYP2C9 P11712 2/20 0.43
▸ PTGS1 P23219 2/20 0.43
▸ MEN1 O00255 4/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ TDP1 Q9NUW8 3/20 0.42
▸ USP2 O75604 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ BLVRB P30043 2/20 0.37
▸ PDE4A P27815 1/20 0.37
▸ KDR P35968 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ APP P05067 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ BLM P54132 1/20 0.36

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 0.93 GLO1 (0.46) THRBPHLPP2PTGS2ALDH1A1HSD17B10
SCHEMBL22413443 0.93 THRB (0.40) THRBPHLPP2PTGS2ALDH1A1HSD17B10
SCHEMBL22413386 0.93 GLO1 (0.46) THRBPHLPP2PTGS2ALDH1A1HSD17B10
SCHEMBL22256305 0.91 MEN1 (0.45) THRBPHLPP2PTGS2ALDH1A1HSD17B10
SCHEMBL22413435 0.90 PHLPP2 (0.45) THRBPHLPP2PTGS2ALDH1A1HSD17B10
SCHEMBL22256302 0.90 PHLPP2 (0.45) THRBPHLPP2PTGS2ALDH1A1HSD17B10
SCHEMBL22411683 0.90 PHLPP2 (0.45) THRBPHLPP2PTGS2ALDH1A1HSD17B10
SCHEMBL22256415 0.90 THRB (0.44) THRBPHLPP2PTGS2ALDH1A1HSD17B10
SCHEMBL22413418 0.89 GLO1 (0.48) THRBPHLPP2PTGS2ALDH1A1HSD17B10
SCHEMBL22256362 0.89 PHLPP2 (0.39) THRBPHLPP2PTGS2ALDH1A1HSD17B10

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