SCHEMBL6164416

SCHEMBL6164416

O=C(CO)NCc1cccnc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.71
CYP3A4 P08684 2/20 0.68
RECQL P46063 1/20 0.68
CYP1A2 P05177 1/20 0.68
CYP2C9 P11712 1/20 0.68
CYP2C19 P33261 1/20 0.68
SMN1; SMN2 Q16637 3/20 0.64
LMNA P02545 2/20 0.64
HTT P42858 2/20 0.64
HPGD P15428 1/20 0.64
GAA P10253 1/20 0.64
ALDH1A1 P00352 2/20 0.62
FES P07332 1/20 0.60
RET P07949 1/20 0.60
MARK3 P27448 1/20 0.60
TYK2 P29597 1/20 0.60
FLT4 P35916 1/20 0.60
SYK P43405 1/20 0.60
CLK2 P49760 1/20 0.60
CLK4 Q9HAZ1 1/20 0.60

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
SCHEMBL16610098 0.88 MAPT (0.84) MAPTCYP3A4RECQLCYP1A2CYP2C9
SCHEMBL31321081 0.85 MAPT (0.69) MAPTCYP3A4RECQLCYP1A2CYP2C9
SCHEMBL10023 0.85 MAPT (0.69) MAPTCYP3A4RECQLCYP1A2CYP2C9
SCHEMBL3253283 0.85 CYP3A4 (0.70) MAPTCYP3A4RECQLCYP1A2CYP2C9
SCHEMBL1274303 0.85 RECQL (0.71) MAPTCYP3A4RECQLCYP1A2CYP2C9
SCHEMBL8288445 0.85 MAPT (0.69) MAPTCYP3A4RECQLCYP1A2CYP2C9
SCHEMBL2698429 0.85 MAPT (0.69) MAPTCYP3A4RECQLCYP1A2CYP2C9
SCHEMBL28851928 0.84 MAPT (0.83) MAPTCYP3A4RECQLCYP1A2CYP2C9
SCHEMBL9130703 0.84 FES (0.81) MAPTCYP3A4RECQLCYP1A2CYP2C9
SCHEMBL29460250 0.84 FES (0.81) MAPTCYP3A4RECQLCYP1A2CYP2C9

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 MAPT 4734/4885CYP3A4 238/4885RECQL 217/4885

“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.