SCHEMBL22413439

SCHEMBL22413439

C=CS(=O)(=O)c1ccc(N=Nc2c(O)cc(C(=O)O)c(N=Nc3ccc(S(=O)(=O)CCOS(=O)(=O)O)cc3)c2O)c(S(=O)(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 5/20 0.42
▸ PRMT1 Q99873 1/20 0.39
▸ THRB P10828 1/20 0.38
▸ CD40 P25942 1/20 0.36
▸ CD40LG P29965 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ ENPP2 Q13822 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ CYP2C9 P11712 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ PTGS1 P23219 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ MPL P40238 1/20 0.33
▸ ATIC P31939 1/20 0.33
▸ P2RX5 Q93086 1/20 0.33

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
SCHEMBL22411683 0.94 PHLPP2 (0.45) PHLPP2THRBCD40CD40LGMEN1
SCHEMBL22413435 0.94 PHLPP2 (0.45) PHLPP2THRBCD40CD40LGMEN1
SCHEMBL22256302 0.94 PHLPP2 (0.45) PHLPP2THRBCD40CD40LGMEN1
SCHEMBL22256264 0.91 PHLPP2 (0.39) PHLPP2PRMT1THRBCD40CD40LG
SCHEMBL22413443 0.91 THRB (0.40) PHLPP2PRMT1THRBMEN1USP2
SCHEMBL22413436 0.90 PHLPP2 (0.41) PHLPP2THRBCD40CD40LGMEN1
SCHEMBL22413394 0.90 PHLPP2 (0.42) PHLPP2THRBCD40CD40LGMEN1
SCHEMBL22256261 0.89 MEN1 (0.42) PHLPP2THRBCD40CD40LGMEN1
SCHEMBL22256308 0.89 PHLPP2 (0.49) PHLPP2THRBCD40CD40LGMEN1
SCHEMBL22256332 0.88 PHLPP2 (0.48) PHLPP2THRBCD40CD40LGMEN1

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
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