SCHEMBL6417031

SCHEMBL6417031

NN=C(c1ccc(C(=O)O)cc1)c1nc2nonc2nc1Nc1ccc(F)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 13/20 0.44
CSNK2A2 P19784 2/20 0.44
CSNK2B P67870 2/20 0.44
EGFR P00533 2/20 0.41
TDO2 P48775 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.38
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ERBB2 P04626 1/20 0.37
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL6417016 1.00 CSNK2A1 (0.44) CSNK2A1CSNK2A2CSNK2BEGFRTDO2
SCHEMBL6415683 0.92 CSNK2A1 (0.45) CSNK2A1CSNK2A2CSNK2BEGFRABCG2
SCHEMBL6415701 0.92 CSNK2A1 (0.45) CSNK2A1CSNK2A2CSNK2BEGFRABCG2
SCHEMBL6418314 0.90 MAPT (0.39) CSNK2A1CSNK2A2CSNK2BEGFRTDO2
SCHEMBL6418336 0.90 MAPT (0.39) CSNK2A1CSNK2A2CSNK2BEGFRTDO2
SCHEMBL6414872 0.89 RPA1 (0.43) CSNK2A1CSNK2A2CSNK2BEGFRTDO2
SCHEMBL6431840 0.86 CSNK2A1 (0.46) CSNK2A1CSNK2A2CSNK2BMAPTSMN1; SMN2
SCHEMBL6431857 0.86 CSNK2A1 (0.46) CSNK2A1CSNK2A2CSNK2BMAPTSMN1; SMN2
SCHEMBL6440251 0.84 TP53 (0.41) EGFRTDO2ABCG2MAPTSMN1; SMN2
SCHEMBL6440257 0.84 TP53 (0.41) EGFRTDO2ABCG2MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050143382-A1 Heterocyclic compounds as pharmaceutically active compounds 4SC AG (DE) 2005-06-30 US disclosed
WO-2005044270-A1 OXADIAZOLOPYRAZINE DERIVATIVES AS PHARMACEUTICALLY ACTIVE COMPOUNDS 4SC AG (DE) 2005-05-19 WO disclosed
EP-1529531-A1 Oxadiazolopyrazine derivatives as pharmaceutically active compounds 4SC AG (DE) 2005-05-11 EP 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 (1 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-20050143382-A1 Heterocyclic compounds as pharmaceutically active compounds NR5A2, NR1H2, NR2C2 CSNK2A1 953/4885CSNK2A2 723/4885CSNK2B 714/4885

“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.