SCHEMBL13629437

SCHEMBL13629437

NC(=O)c1ccc(Cl)c(N=Nc2ccc(N=Nc3c(S(=O)(=O)O)cc4cc(S(=O)(=O)O)c(N)cc4c3O)c3cc(S(=O)(=O)O)ccc23)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
THRB P10828 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CD40 P25942 1/20 0.43
CD40LG P29965 1/20 0.43
ENPP2 Q13822 7/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP1A2 P05177 2/20 0.42
HIF1A Q16665 2/20 0.42
SENP3 Q9H4L4 3/20 0.42
SENP2 Q9HC62 3/20 0.42
SENP1 Q9P0U3 3/20 0.42
SUMO2 P61956 2/20 0.42
SUMO1 P63165 2/20 0.42
SENP7 Q9BQF6 2/20 0.42
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PTPN11 Q06124 1/20 0.40

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
SCHEMBL14339110 0.90 ENPP2 (0.50) MEN1KMT2ATHRBTDP1CD40
SCHEMBL13629259 0.89 CD40 (0.52) MEN1KMT2ATHRBTDP1CD40
SCHEMBL13615266 0.89 MEN1 (0.41) MEN1KMT2ATHRBTDP1CD40
SCHEMBL13629442 0.89 ALDH1A1 (0.53) MEN1KMT2ATHRBTDP1CD40
SCHEMBL13629441 0.87 ENPP2 (0.53) MEN1KMT2ATHRBTDP1CD40
SCHEMBL13629282 0.86 CD40 (0.49) MEN1KMT2ATHRBTDP1CD40
SCHEMBL9777466 0.86 SENP3 (0.53) MEN1KMT2ATHRBTDP1CD40
SCHEMBL9777468 0.86 SENP3 (0.53) MEN1KMT2ATHRBTDP1CD40
SCHEMBL14339183 0.84 SENP3 (0.57) MEN1KMT2ATHRBTDP1CD40
SCHEMBL9332175 0.83 CD40 (0.57) MEN1KMT2ATHRBTDP1CD40

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 2 patents. 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
EP-1867684-A1 COLORING MATTER FOR ANISOTROPIC COLORING MATTER FILM, COMPOSITION COMPRISING SAID COLORING MATTER, ANISOTROPIC COLORING MATTER FILM, AND POLARIZING ELEMENT Mitsubishi Chemical Corporation (JP) 2007-12-19 EP disclosed