SCHEMBL13657702

SCHEMBL13657702

[2H]c1nc(C([2H])([2H])Sc2nc3nc(OC([2H])([2H])[2H])ccc3[nH]2)c(C([2H])([2H])[2H])c([N+](=O)[O-])c1C([2H])([2H])[2H]

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 1/20 0.34
ENPP1 P22413 1/20 0.34
ENPP2 Q13822 1/20 0.34
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
DDAH1 O94760 1/20 0.32
SARM1 Q6SZW1 1/20 0.32
IDO2 Q6ZQW0 1/20 0.32
ENGASE Q8NFI3 1/20 0.32
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL13645453 0.84 SENP1 (0.37) MAPT
SCHEMBL13645441 0.81 SENP1 (0.41) MAPT
Ufiprazole SCHEMBL13645428 0.69 BRS3 (0.42)
Tenatoprazole SCHEMBL13657643 0.69 DDAH1 (0.36) DDAH1SARM1IDO2ENGASE
Tenatoprazole SCHEMBL13657629 0.65 DDAH1 (0.39) DDAH1SARM1IDO2ENGASE
Tenatoprazole SCHEMBL13657683 0.64 DDAH1 (0.32) DDAH1SARM1IDO2ENGASE
Tenatoprazole SCHEMBL13657679 0.64 DDAH1 (0.35) DDAH1SARM1IDO2ENGASE
Tenatoprazole SCHEMBL13657637 0.64 DDAH1 (0.42) DDAH1SARM1IDO2ENGASE
Tenatoprazole SCHEMBL13657650 0.64 DDAH1 (0.40) DDAH1SARM1IDO2ENGASE
SCHEMBL13657695 0.64

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-20090258897-A1 Substituted benzimidazoles AUSPEX PHARMACEUTICALS, INC. (US) 2009-10-15 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 (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-20090258897-A1 Substituted benzimidazoles ABCB11, CYP2C19, HRH2 ENPP3 1968/4885ENPP1 1397/4885ENPP2 3896/4885

“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.