SCHEMBL13615304

SCHEMBL13615304

Nc1ccc2cc(SOOO)c(N=Nc3ccc(N=Nc4cnc5ccccc5c4)c4ccc(S(=O)(=O)O)cc34)c(O)c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 3/20 0.39
MEN1 O00255 1/20 0.39
THRB P10828 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SENP2 Q9HC62 5/20 0.38
SENP1 Q9P0U3 5/20 0.38
SENP3 Q9H4L4 4/20 0.38
SUMO2 P61956 2/20 0.38
SUMO1 P63165 2/20 0.38
SENP7 Q9BQF6 2/20 0.38
HSD17B10 Q99714 3/20 0.38
CYP2C9 P11712 3/20 0.38
CYP1A2 P05177 3/20 0.38
CYP2C19 P33261 2/20 0.38
HIF1A Q16665 2/20 0.38
TSHR P16473 1/20 0.38
PTPRA P18433 1/20 0.38
PTPRB P23467 1/20 0.38
RAPGEF4 Q8WZA2 1/20 0.38

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
SCHEMBL13921667 0.92 MEN1 (0.42) PTPN11MEN1THRBKMT2ATDP1
SCHEMBL13615322 0.92 MEN1 (0.42) PTPN11MEN1THRBKMT2ATDP1
SCHEMBL13615291 0.92 MEN1 (0.42) PTPN11MEN1THRBKMT2ATDP1
SCHEMBL13774640 0.90 CYP2C9 (0.38) PTPN11MEN1THRBKMT2ATDP1
SCHEMBL13629227 0.88 MEN1 (0.47) MEN1THRBKMT2ATDP1SENP2
SCHEMBL13615136 0.87 ATIC (0.47) PTPN11MEN1THRBKMT2ATDP1
SCHEMBL13615333 0.84 PTPN11 (0.42) PTPN11MEN1THRBKMT2ATDP1
SCHEMBL13615294 0.83 PTPN11 (0.46) PTPN11MEN1THRBKMT2ATDP1
SCHEMBL13615318 0.83 PTPN11 (0.46) PTPN11MEN1THRBKMT2ATDP1
SCHEMBL13615326 0.83 ALDH1A1 (0.40) PTPN11MEN1THRBKMT2ATDP1

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-20090275742-A1 COLORING MATTER FOR ANISOTROPIC COLORING MATTER FILM, COMPOSITION COMPRISING SAID COLORING MATTER, ANISOTROPIC COLORING MATTER FILM, AND POLARIZING ELEMENT MITSUBISHI CHEMICAL CORPORATION (JP) 2009-11-05 US disclosed