SCHEMBL13425428

SCHEMBL13425428

Nc1nc(SCCCCSc2nc(N)c(/N=N/c3cc(SOOO)ccc3S(=O)(=O)O)c(N)n2)nc(N)c1/N=N/c1cc(S(=O)(=O)O)ccc1SOOO

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 1/20 0.36
▸ P2RX3 P56373 2/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ TDP1 Q9NUW8 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ P2RX2 Q9UBL9 1/20 0.32
▸ ENPP2 Q13822 1/20 0.30
▸ THRB P10828 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
SCHEMBL13456087 0.85 P2RX3 (0.39) PTPN11P2RX3MEN1KMT2ATDP1
SCHEMBL13949393 0.84 MEN1 (0.38) PTPN11MEN1KMT2ATDP1HSD17B10
SCHEMBL13425384 0.82 PTPN11 (0.42) PTPN11
SCHEMBL13949394 0.78 MEN1 (0.40) PTPN11P2RX3MEN1KMT2ATDP1
SCHEMBL13425385 0.78 P2RX3 (0.38) PTPN11P2RX3MEN1KMT2ATDP1
SCHEMBL13425395 0.78 PTPN11 (0.46) PTPN11MEN1KMT2ATDP1ENPP2
SCHEMBL13425424 0.78 PTPN11 (0.32) PTPN11P2RX3MEN1KMT2ATDP1
SCHEMBL13456085 0.76 ENPP2 (0.39) PTPN11P2RX3MEN1KMT2ATDP1
SCHEMBL13970275 0.73 MEN1 (0.44) PTPN11P2RX3MEN1KMT2ATDP1
SCHEMBL13802980 0.71 PTPN11 (0.47) PTPN11MEN1KMT2ATDP1KDM4E

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-20100068472-A1 Yellow Azo Dyes for Ink Jet Printing FUJIFILM IMAGING COLORANTS LIMITED (GB) 2010-03-18 — — US disclosed
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