SCHEMBL14351150

SCHEMBL14351150

COc1cc(N=Nc2ccc3cc(S(=O)(=O)O)c(N=Nc4cc(OC)c(N=Nc5ccc(N)cc5S(=O)(=O)O)cc4OC)c(O)c3c2)c(OC)cc1N

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 1/20 0.55
▸ ENPP2 Q13822 10/20 0.55
▸ CD40 P25942 1/20 0.44
▸ CD40LG P29965 1/20 0.44
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ APEX1 P27695 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ BRCA1 P38398 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ BLM P54132 1/20 0.42
▸ SLC10A1 Q14973 1/20 0.42

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
SCHEMBL14339482 0.88 ENPP2 (0.44) PHLPP2ENPP2CD40CD40LGMEN1
SCHEMBL14351144 0.86 PHLPP2 (0.52) PHLPP2ENPP2CD40CD40LGMEN1
SCHEMBL14351159 0.85 ENPP2 (0.53) PHLPP2ENPP2CD40CD40LGMEN1
SCHEMBL31489850 0.85 PHLPP2 (0.55) PHLPP2ENPP2CD40CD40LGCA2
SCHEMBL29368994 0.84 CD40 (0.52) PHLPP2ENPP2CD40CD40LGMEN1
SCHEMBL29462260 0.84 PHLPP2 (0.63) PHLPP2ENPP2CD40CD40LGMEN1
SCHEMBL12915463 0.84 ENPP2 (0.55) PHLPP2ENPP2MEN1KMT2AAPEX1
SCHEMBL29501270 0.83 ENPP2 (0.57) PHLPP2ENPP2MEN1KMT2AALDH1A1
SCHEMBL10600651 0.82 PHLPP2 (0.51) PHLPP2ENPP2CD40CD40LGMEN1
SCHEMBL14351151 0.82 ENPP2 (0.50) PHLPP2ENPP2CD40CD40LGMEN1

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-20070287830-A1 Trisazo Dye, Composition Containing the Same for Anisotropic Dye Film, Anisotropic Dye Film, and Polarizing Element MITSUBISHI CHEMICAL CORPORATION (JP) 2007-12-13 — — US disclosed
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