SCHEMBL5406540

SCHEMBL5406540

O=C(O)c1ccc(C(=O)NN2CCCC2)cc1

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.73
CYP2D6 P10635 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
PKM P14618 1/20 0.50
ALDH1A1 P00352 1/20 0.50
KMT2A Q03164 1/20 0.50
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45

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
SCHEMBL2399935 0.86 HTT (0.96) HTTSMN1; SMN2PKMALDH1A1KMT2A
N-Piperidinobenzamide SCHEMBL696161 0.85 HTT (1.00) HTTSMN1; SMN2PKMALDH1A1KMT2A
SCHEMBL9282775 0.85 HTT (1.00) HTTSMN1; SMN2PKMALDH1A1KMT2A
SCHEMBL55036 0.83 HTT (0.66) HTTCYP2D6SMN1; SMN2PKMALDH1A1
SCHEMBL280280 0.83 CYP2D6 (0.73) HTTCYP2D6SMN1; SMN2ALDH1A1KMT2A
SCHEMBL4959035 0.83 HTT (0.66) HTTCYP2D6SMN1; SMN2PKMALDH1A1
SCHEMBL1664142 0.82 HTT (0.51) HTTCYP2D6SMN1; SMN2ALDH1A1KMT2A
SCHEMBL12629113 0.81 CYP2D6 (0.71) HTTCYP2D6SMN1; SMN2ALDH1A1KMT2A
SCHEMBL8018069 0.81 CYP2D6 (0.53) HTTCYP2D6SMN1; SMN2ALDH1A1KMT2A
SCHEMBL14562953 0.81 HTT (0.62) HTTCYP2D6SMN1; SMN2PKMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7173024-B2 Compounds having prolyl oligopeptidase inhibitory activity, methods for their preparation and their use ORION CORPORATION (FI) 2007-02-06 US disclosed
US-20050020677-A1 Compounds having prolyl oligopeptidase inhibitory activity, methods for their preparation and their use ORION CORPORATION (FI) 2005-01-27 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-20050020677-A1 Compounds having prolyl oligopeptidase inhibitory activity, methods for their preparation and their use DNPEP, PREP, ANPEP HTT 386/4885CYP2D6 1786/4885SMN1; SMN2 2511/4885

“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.