SCHEMBL5522089

SCHEMBL5522089

CCN(C)C(=O)c1cc(-c2ccc(CN)cn2)n(-c2ccc(C)nc2)n1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 1/20 0.35
NTRK1 P04629 1/20 0.33
RPA1 P27694 2/20 0.32
CCNE1 P24864 1/20 0.31
CDK2 P24941 1/20 0.31
GSK3B P49841 1/20 0.31
PDE11A Q9HCR9 1/20 0.31
CA9 Q16790 2/20 0.31
ELANE P08246 1/20 0.30
SPR P35270 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
SCHEMBL5524300 0.88 CYP11B1 (0.37) MALT1CCNE1CDK2GSK3B
SCHEMBL5524209 0.88 PIK3CA (0.35) MALT1RPA1CCNE1CDK2GSK3B
SCHEMBL5520085 0.87 MALT1 (0.37) MALT1NTRK1RPA1PDE11ACA9
SCHEMBL5530272 0.87 WDR5 (0.34) MALT1RPA1
SCHEMBL5525372 0.86 MALT1 (0.35) MALT1RPA1CCNE1CDK2GSK3B
SCHEMBL5979134 0.86 NAMPT (0.35) MALT1RPA1ELANE
SCHEMBL14416571 0.86 RPA1 (0.36) MALT1RPA1CCNE1CDK2GSK3B
SCHEMBL5517681 0.86 MALT1 (0.35) MALT1RPA1CCNE1CDK2GSK3B
SCHEMBL5519940 0.85 RPA1 (0.38) MALT1RPA1
SCHEMBL5530270 0.84 MALT1 (0.34) MALT1NTRK1RPA1PDE11A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070219210-A1 Amidopyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-09-20 US disclosed
CN-1902191-A Amidopyrazole derivative DAIICHI SEIYAKU CO (JP) 2007-01-24 CN disclosed
EP-1698626-A1 AMIDOPYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-09-06 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-20070219210-A1 Amidopyrazole Derivative PTGER1, PTGS1, PTGER2 MALT1 3117/4885NTRK1 3841/4885RPA1 1661/4885

“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.