SCHEMBL13989649

SCHEMBL13989649

Cc1c(N)c(NCCO)nc(NCCO)c1/N=N/c1ccc(S(=O)(=O)CCN(CC(C)O)CC(C)O)cc1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.32
▸ SYK P43405 1/20 0.30

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
SCHEMBL13893726 0.92 SYK (0.31) SYK
SCHEMBL12726033 0.90 THRB (0.34) THRBSYK
SCHEMBL12704486 0.87 KMT2A (0.38) —
SCHEMBL12726029 0.86 THRB (0.33) THRBSYK
SCHEMBL13989673 0.84 GAA (0.31) —
SCHEMBL14541230 0.82 ALDH1A1 (0.34) —
SCHEMBL12704502 0.81 MAPK8 (0.34) —
SCHEMBL12704485 0.77 KMT2A (0.40) —
SCHEMBL12725999 0.76 GAA (0.32) —
SCHEMBL12726000 0.76 GAA (0.32) —

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-20080312352-A1 Dyes and Dye Mixtures for Dying Polymers, Method for the Production Thereof and Their Use DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2008-12-18 — — US disclosed
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