SCHEMBL31489889

SCHEMBL31489889

COc1cc(N=Nc2ccc(S(=O)(=O)O)cc2)c(C)cc1N=Nc1c(S(=O)(=O)O)cc2cc(N)ccc2c1O

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 11/20 0.63
PHLPP2 Q6ZVD8 1/20 0.59
CD40 P25942 1/20 0.51
CD40LG P29965 1/20 0.51
ALDH1A1 P00352 1/20 0.47
HIF1A Q16665 1/20 0.47
PTPN1 P18031 2/20 0.47
MEN1 O00255 1/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 1/20 0.45
CA2 P00918 1/20 0.44
CA3 P07451 1/20 0.44

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
SCHEMBL31490038 0.95 PHLPP2 (0.64) ENPP2PHLPP2CD40CD40LGCA2
SCHEMBL10615183 0.92 ENPP2 (0.62) ENPP2PHLPP2CD40CD40LGALDH1A1
SCHEMBL29501270 0.90 ENPP2 (0.57) ENPP2PHLPP2ALDH1A1PTPN1MEN1
SCHEMBL12915463 0.89 ENPP2 (0.55) ENPP2PHLPP2ALDH1A1PTPN1MEN1
SCHEMBL31489850 0.89 PHLPP2 (0.55) ENPP2PHLPP2CD40CD40LGPTPN1
SCHEMBL19235084 0.88 ENPP2 (0.68) ENPP2PHLPP2CD40CD40LGCA2
SCHEMBL20747585 0.88 ENPP2 (0.68) ENPP2PHLPP2CD40CD40LGCA2
SCHEMBL19234838 0.88 ENPP2 (0.68) ENPP2PHLPP2CD40CD40LGCA2
SCHEMBL19235090 0.88 ENPP2 (0.61) ENPP2PHLPP2CD40CD40LGALDH1A1
SCHEMBL17545778 0.87 ENPP2 (0.67) ENPP2PHLPP2CD40CD40LGALDH1A1

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
CN-119799030-A Polyazo dyes or their complexes, process for their preparation and their use 广东省科学院测试分析研究所(中国广州分析测试中心) 2025-04-11 CN disclosed