SCHEMBL11221798

SCHEMBL11221798

O=S(=O)(O)c1cc2cc(S(=O)(=O)O)c(/N=N/c3ccc(S(=O)(=O)O)c4ccccc34)c(O)c2c(O)c1/N=N/c1ccc(S(=O)(=O)O)c2ccccc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 2/20 0.65
▸ MEN1 O00255 2/20 0.65
▸ KMT2A Q03164 2/20 0.65
▸ TDP1 Q9NUW8 1/20 0.65
▸ CTRB1 P17538 1/20 0.64
▸ CYP1A2 P05177 4/20 0.63
▸ MAPK1 P28482 2/20 0.63
▸ CYP2C9 P11712 1/20 0.63
▸ DNASE1L3 Q13609 1/20 0.63
▸ ENPP2 Q13822 2/20 0.59
▸ MPL P40238 4/20 0.54
▸ CTRC Q99895 1/20 0.54
▸ PHLPP2 Q6ZVD8 1/20 0.53
▸ PRMT1 Q99873 1/20 0.53
▸ ALDH1A1 P00352 2/20 0.50
▸ NSD2 O96028 1/20 0.50
▸ MMP14 P50281 1/20 0.50
▸ CASP6 P55212 1/20 0.50
▸ HIF1A Q16665 1/20 0.50
▸ HTT P42858 1/20 0.49

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
SCHEMBL7069582 1.00 THRB (0.65) THRBMEN1KMT2ATDP1CTRB1
SCHEMBL11227186 0.90 CYP1A2 (0.80) THRBMEN1KMT2ATDP1CTRB1
SCHEMBL29767885 0.90 CYP1A2 (0.80) THRBMEN1KMT2ATDP1CTRB1
SCHEMBL11227192 0.90 CYP1A2 (0.80) THRBMEN1KMT2ATDP1CTRB1
SCHEMBL3349622 0.85 THRB (0.82) THRBMEN1KMT2ATDP1CTRB1
SCHEMBL1472408 0.83 CYP1A2 (0.62) THRBMEN1KMT2ATDP1CYP1A2
SCHEMBL1472399 0.83 CYP1A2 (0.62) THRBMEN1KMT2ATDP1CYP1A2
SCHEMBL14418371 0.83 CYP1A2 (0.67) THRBMEN1KMT2ATDP1CTRB1
SCHEMBL31525848 0.83 CYP1A2 (0.67) THRBMEN1KMT2ATDP1CTRB1
SCHEMBL11763437 0.83 CYP1A2 (0.67) THRBMEN1KMT2ATDP1CTRB1

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-4361842-A INK JET CANON KABUSHIKI KAISHA (JP) 1982-11-30 — — US disclosed
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