SCHEMBL5443256

SCHEMBL5443256

CCSC(C(=O)O)c1nc2c(nc1C#N)c(=O)n(C)c(=O)n2C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.35
KDM4E B2RXH2 5/20 0.35
HPGD P15428 2/20 0.35
HTT P42858 2/20 0.35
JAK2 O60674 1/20 0.35
LMNA P02545 1/20 0.35
PAX8 Q06710 1/20 0.35
MAPT P10636 4/20 0.33
GAA P10253 3/20 0.33
POLB P06746 2/20 0.33
THRB P10828 1/20 0.33
BLM P54132 1/20 0.33
GLA P06280 1/20 0.33
ADORA2A P29274 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALOX15 P16050 1/20 0.33
RXFP1 Q9HBX9 1/20 0.32

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
SCHEMBL6314837 0.82 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDHTTJAK2
SCHEMBL6313912 0.69 ALDH1A1 (0.58) ALDH1A1KDM4EHPGDHTTJAK2
SCHEMBL6316332 0.69 ALDH1A1 (0.62) ALDH1A1KDM4EHPGDHTTJAK2
SCHEMBL6396069 0.68 MAPT (0.40) ALDH1A1KDM4EHPGDHTTJAK2
SCHEMBL6321979 0.65 MAPT (0.40) ALDH1A1KDM4EHPGDHTTJAK2
SCHEMBL6317109 0.64 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDHTTJAK2
SCHEMBL26312966 0.63 ALDH1A1 (0.66) ALDH1A1KDM4EHPGDHTTJAK2
SCHEMBL6315606 0.62 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDHTTJAK2
SCHEMBL5448291 0.61 ALDH1A1 (0.73) ALDH1A1KDM4EHPGDHTTJAK2
SCHEMBL12355771 0.60 ALDH1A1 (0.61) ALDH1A1KDM4EHPGDHTTJAK2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636232-A2 IMMUNOSUPPRESSIVE EFFECTS OF PTERIDINE DERIVATIVES 4 AZA Bioscience nv (BE) 2006-03-22 EP claimed
US-6946465-B2 Immunosuppressive effects of pteridine derivatives 4 AZA BIOSCIENCE NV (BE) 2005-09-20 US claimed
WO-2004104005-A2 IMMUNOSUPPRESSIVE EFFECTS OF PTERIDINE DERIVATIVES 4 AZA BIOSCIENCE NV (BE) 2004-12-02 WO claimed
US-20030236255-A1 Immunosuppressive effects of pteridine derivatives 4 AZA BIOSCIENCE NV (BE) 2003-12-25 US claimed
US-20070043000-A1 Immunosuppresive effects of pteridine derivatives 4 AZA BIOSCIENCE NV (BE) 2007-02-22 US disclosed
EP-1636232-A2 IMMUNOSUPPRESSIVE EFFECTS OF PTERIDINE DERIVATIVES 4 AZA Bioscience nv (BE) 2006-03-22 EP disclosed
US-6946465-B2 Immunosuppressive effects of pteridine derivatives 4 AZA BIOSCIENCE NV (BE) 2005-09-20 US disclosed
WO-2004104005-A2 IMMUNOSUPPRESSIVE EFFECTS OF PTERIDINE DERIVATIVES 4 AZA BIOSCIENCE NV (BE) 2004-12-02 WO disclosed
EP-1479682-A1 Immunosuppressive effects of pteridine derivatives 4 AZA Bioscience nv (BE) 2004-11-24 EP disclosed
US-20030236255-A1 Immunosuppressive effects of pteridine derivatives 4 AZA BIOSCIENCE NV (BE) 2003-12-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070043000-A1 Immunosuppresive effects of pteridine derivatives TPMT, FKBP5, RRP15 ALDH1A1 1767/4885KDM4E 1686/4885HPGD 1339/4885
US-20030236255-A1 Immunosuppressive effects of pteridine derivatives TPMT, FKBP5, RRP15 ALDH1A1 1744/4885KDM4E 1278/4885HPGD 1752/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.