SCHEMBL6164413

SCHEMBL6164413

CN(C(=O)C[O])c1cccnc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.58
POLQ O75417 1/20 0.52
TRPV1 Q8NER1 1/20 0.50
PYGL P06737 1/20 0.46
HTT P42858 1/20 0.44
CHRNB2 P17787 1/20 0.41
CHRNA4 P43681 1/20 0.41
GAA P10253 2/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
KDM4E B2RXH2 1/20 0.40
KMT2A Q03164 1/20 0.40
NAPRT Q6XQN6 1/20 0.40
RIPK1 Q13546 1/20 0.39
KCNN4 O15554 1/20 0.39
KCNA5 P22460 1/20 0.39

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
SCHEMBL25629360 0.86 NOTUM (0.58) NOTUMPOLQTRPV1PYGLHTT
SCHEMBL16166142 0.83 NOTUM (0.56) NOTUMPOLQTRPV1PYGLHTT
SCHEMBL2435091 0.83 NOTUM (0.56) NOTUMPOLQTRPV1PYGLHTT
SCHEMBL16353843 0.82 NOTUM (0.54) NOTUMPOLQTRPV1PYGLHTT
SCHEMBL25733507 0.81 NOTUM (0.56) NOTUMPOLQTRPV1PYGLHTT
SCHEMBL3884249 0.81 NOTUM (0.56) NOTUMPOLQTRPV1HTTCHRNB2
SCHEMBL3576501 0.80 NOTUM (0.51) NOTUMPOLQTRPV1PYGLHTT
SCHEMBL965251 0.80 NOTUM (0.51) NOTUMPOLQTRPV1HTTGAA
SCHEMBL27657777 0.80 NOTUM (0.59) NOTUMPOLQTRPV1PYGLHTT
SCHEMBL16353627 0.80 NOTUM (0.52) NOTUMPOLQTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050187264-A1 Phosphodiesterase iv inhibitor containing pyridylacrylamide derivative TSUMURA & CO. (JP) 2005-08-25 US disclosed
EP-1495757-A1 PHOSPHODIESTERASE IV INHIBITOR CONTAINING PYRIDYLACRYLAMIDE DERIVATIVE TSUMURA & CO. (JP) 2005-01-12 EP disclosed
US-6313153-B1 ADMINISTERING PYRIDYLACRYLAMIDE COMPOUND FOR THERAPY OF NEPHRITIS TSUMURA & CO. (JP) 2001-11-06 US disclosed
EP-1000935-A1 PYRIDYLACRYLAMIDE DERIVATIVES AND NEPHRITIS REMEDIES AND TGF-$g(b) INHIBITORS CONTAINING THE SAME TSUMURA & CO. (JP) 2000-05-17 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-20050187264-A1 Phosphodiesterase iv inhibitor containing pyridylacrylamide derivative PDE3B, PDE3A, PDE2A NOTUM 1974/4885POLQ 1501/4885TRPV1 2412/4885

“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.