SCHEMBL4479411

SCHEMBL4479411

CC(=O)Nc1[nH]cc(-c2ccc(N)nc2)c1C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K11 Q16584 4/20 0.48
MKNK1 Q9BUB5 1/20 0.44
MKNK2 Q9HBH9 1/20 0.44
CYP3A4 P08684 1/20 0.43
PIK3CA P42336 1/20 0.43
TDO2 P48775 3/20 0.40
CLK1 P49759 4/20 0.40
DYRK1A Q13627 1/20 0.40
DYRK2 Q92630 1/20 0.40
DYRK1B Q9Y463 1/20 0.40
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 1/20 0.40
CDC42BPB Q9Y5S2 1/20 0.40
MAPK1 P28482 1/20 0.39
LRRK2 Q5S007 1/20 0.39
NNMT P40261 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CHEK2 O96017 1/20 0.38
NTRK1 P04629 1/20 0.38
KDM4E B2RXH2 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
SCHEMBL4486233 0.84 PKM (0.37) CYP3A4CLK1DYRK1ADYRK2DYRK1B
SCHEMBL4476072 0.82 DYRK1A (0.37) MAP3K11CYP3A4TDO2CLK1DYRK1A
SCHEMBL4482796 0.76 KDR (0.53) SMN1; SMN2ALDH1A1KIT
SCHEMBL4470895 0.76 DYRK1A (0.48) CYP3A4DYRK1ADYRK1BMAPK1SMN1; SMN2
SCHEMBL4490967 0.76 NPC1 (0.54) CYP3A4DYRK1AROCK2ROCK1MAPK1
SCHEMBL4472148 0.75 IDO1 (0.46) TDO2MAPK1SMN1; SMN2ALDH1A1KIT
SCHEMBL4491792 0.73 MEN1 (0.57) ROCK2ROCK1GAAKIT
SCHEMBL4473208 0.72 EPHX2 (0.50) SMN1; SMN2KIT
SCHEMBL4465203 0.72 KDR (0.47) MKNK2CLK1DYRK1ADYRK2DYRK1B
SCHEMBL4481618 0.72 ROCK2 (0.51) MKNK2CYP3A4TDO2DYRK1AROCK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7592365-B2 Substituted pyrroles, compositions containing same, method for making same and use thereof AVENTIS PHARMA S.A. (FR) 2009-09-22 US disclosed
US-7592365-B2 Substituted pyrroles, compositions containing same, method for making same and use thereof AVENTIS PHARMA S.A. (FR) 2009-09-22 US disclosed
EP-1851198-B1 SUBSTITUTED PYRROLES, COMPOSITIONS CONTAINING SAME, METHOD FOR MAKING SAME AND USE THEREOF AVENTIS PHARMA SA (FR) 2008-12-31 EP disclosed
US-20080167368-A1 Substituted Pyrroles, Compositions Containing Same, Method for Making Same and Use Thereof AVENTIS PHARMA S.A. (FR) 2008-07-10 US disclosed
US-20080167368-A1 Substituted Pyrroles, Compositions Containing Same, Method for Making Same and Use Thereof AVENTIS PHARMA S.A. (FR) 2008-07-10 US disclosed
CN-101115716-A Substituted pyrroles, compositions containing same, method for making same and use thereof AVENTIS PHARMA SA (FR) 2008-01-30 CN disclosed
EP-1851198-A1 SUBSTITUTED PYRROLES, COMPOSITIONS CONTAINING SAME, METHOD FOR MAKING SAME AND USE THEREOF Aventis Pharma S.A. (FR) 2007-11-07 EP disclosed
WO-2006084996-A1 SUBSTITUTED PYRROLES, COMPOSITIONS CONTAINING SAME, METHOD FOR MAKING SAME AND USE THEREOF AVENTIS PHARMA S.A. (FR) 2006-08-17 WO 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-20080167368-A1 Substituted Pyrroles, Compositions Containing Same, Method for Making Same and Use Thereof PRMT1, ADPRS, RRM2B MAP3K11 3529/4885MKNK1 4542/4885MKNK2 4348/4885

“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.