SCHEMBL14400292

SCHEMBL14400292

CC(=O)Nc1cc(S(=O)(=O)O)cc2cc(S(=O)(=O)O)c(N=Nc3cc(C)ccc3S(=O)(=O)O)c(O)c12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 2/20 0.52
▸ MEN1 O00255 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ ENPP2 Q13822 7/20 0.51
▸ FUT8 Q9BYC5 1/20 0.50
▸ CYP1A2 P05177 2/20 0.48
▸ CA2 P00918 1/20 0.48
▸ CA3 P07451 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ DNASE1L3 Q13609 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ PHLPP2 Q6ZVD8 1/20 0.44
▸ PRMT3 O60678 1/20 0.42
▸ EP300 Q09472 1/20 0.42
▸ PRMT6 Q96LA8 1/20 0.42
▸ CD40 P25942 1/20 0.42
▸ CD40LG P29965 1/20 0.42

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
SCHEMBL9139032 0.89 CYP1A2 (0.52) PRMT1MEN1HTTKMT2AENPP2
SCHEMBL14400315 0.89 PRMT1 (0.47) PRMT1MEN1HTTKMT2AENPP2
SCHEMBL185815 0.86 ENPP2 (0.56) PRMT1MEN1HTTKMT2AENPP2
SCHEMBL1139743 0.86 ENPP2 (0.56) PRMT1MEN1HTTKMT2AENPP2
SCHEMBL110153 0.86 ENPP2 (0.56) PRMT1MEN1HTTKMT2AENPP2
SCHEMBL14372037 0.86 ENPP2 (0.40) PRMT1MEN1HTTKMT2AENPP2
SCHEMBL27732032 0.85 ENPP2 (0.55) PRMT1MEN1HTTKMT2AENPP2
SCHEMBL185813 0.85 ENPP2 (0.55) PRMT1MEN1HTTKMT2AENPP2
SCHEMBL29959416 0.85 PRMT1 (0.61) PRMT1MEN1HTTKMT2AENPP2
SCHEMBL2618024 0.85 ENPP2 (0.47) PRMT1MEN1HTTKMT2AENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7282070-B2 Reactive dye composition and the use thereof EVERLIGHT USA, INC. (US) 2007-10-16 — — US disclosed
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