SCHEMBL13615111

SCHEMBL13615111

Nc1cc2c(O)c(N=Nc3ccc(N=Nc4ccc5c6c(cccc46)C(=O)NC5=O)c4ccc(S(=O)(=O)O)cc34)c(SOOO)cc2cc1S(=O)(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
THRB P10828 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CYP1A2 P05177 4/20 0.41
HIF1A Q16665 3/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP2C9 P11712 3/20 0.36
MAPK1 P28482 1/20 0.36
DNASE1L3 Q13609 1/20 0.36
ENPP2 Q13822 5/20 0.36
SENP3 Q9H4L4 5/20 0.35
SENP2 Q9HC62 5/20 0.35
SENP1 Q9P0U3 5/20 0.35
SUMO2 P61956 3/20 0.35
SUMO1 P63165 3/20 0.35
SENP7 Q9BQF6 3/20 0.35
CYP2C19 P33261 2/20 0.35
HSD17B10 Q99714 2/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL13615315 0.91 SENP3 (0.42) MEN1THRBKMT2ATDP1CYP1A2
SCHEMBL13615296 0.91 SENP3 (0.42) MEN1THRBKMT2ATDP1CYP1A2
SCHEMBL13921654 0.91 SENP3 (0.42) MEN1THRBKMT2ATDP1CYP1A2
SCHEMBL13629434 0.89 MEN1 (0.49) MEN1THRBKMT2ATDP1CYP1A2
SCHEMBL13615191 0.87 CYP1A2 (0.48) MEN1THRBKMT2ATDP1CYP1A2
SCHEMBL13615308 0.87 ALDH1A1 (0.42) MEN1THRBKMT2ATDP1CYP1A2
SCHEMBL13615325 0.84 SENP3 (0.40) MEN1THRBKMT2ATDP1CYP1A2
SCHEMBL13615280 0.84 MEN1 (0.45) MEN1THRBKMT2ATDP1CYP1A2
SCHEMBL13615310 0.84 GLO1 (0.39) MEN1THRBKMT2ATDP1CYP2C9
SCHEMBL13615139 0.84 MEN1 (0.46) MEN1THRBKMT2ATDP1CYP1A2

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