SCHEMBL14368798

SCHEMBL14368798

COc1cc(N=Nc2cc(OC)c(N=Nc3c(SOOO)cc4cc(NCOc5ccc(N)cc5)ccc4c3O)cc2C)ccc1N=Nc1ccc2cc(SOOO)cc(S(=O)(=O)O)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 11/20 0.47
▸ PHLPP2 Q6ZVD8 1/20 0.39
▸ PTPN11 Q06124 1/20 0.37
▸ CD40 P25942 1/20 0.33
▸ CD40LG P29965 1/20 0.33
▸ PTPN1 P18031 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ APEX1 P27695 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ BRCA1 P38398 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ BLM P54132 1/20 0.33

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
SCHEMBL14368804 0.98 ENPP2 (0.48) ENPP2PHLPP2PTPN11CD40CD40LG
SCHEMBL14368790 0.98 ENPP2 (0.47) ENPP2PHLPP2PTPN11CD40CD40LG
SCHEMBL14357496 0.96 ENPP2 (0.44) ENPP2PHLPP2PTPN11CD40CD40LG
SCHEMBL14368797 0.94 ENPP2 (0.46) ENPP2PHLPP2PTPN11CD40CD40LG
SCHEMBL14368795 0.94 ENPP2 (0.44) ENPP2PHLPP2PTPN11CD40CD40LG
SCHEMBL14357506 0.92 ENPP2 (0.42) ENPP2PHLPP2PTPN11CD40CD40LG
SCHEMBL14357493 0.91 ENPP2 (0.41) ENPP2PHLPP2PTPN11CD40CD40LG
SCHEMBL14357502 0.91 ENPP2 (0.42) ENPP2PHLPP2PTPN11CD40CD40LG
SCHEMBL14368803 0.90 ENPP2 (0.43) ENPP2PHLPP2PTPN11PTPN1
SCHEMBL14368799 0.89 ENPP2 (0.45) ENPP2PHLPP2PTPN11CD40CD40LG

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-7276268-B2 Poly-azo compound, and polarization film having said compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-02 — — US disclosed
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