SCHEMBL5525372

SCHEMBL5525372

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

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 3/20 0.35
WDR5 P61964 3/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
PIK3CA P42336 1/20 0.33
CSF1R P07333 1/20 0.32
RPA1 P27694 3/20 0.32
NAMPT P43490 2/20 0.32
P2RX7 Q99572 1/20 0.32
CACNA1G O43497 1/20 0.32
CACNA1H O95180 1/20 0.32
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
CCNE1 P24864 1/20 0.31
CDK2 P24941 1/20 0.31
GSK3B P49841 1/20 0.31

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
SCHEMBL5524209 0.93 PIK3CA (0.35) MALT1WDR5PIK3CARPA1NAMPT
SCHEMBL5530272 0.92 WDR5 (0.34) MALT1WDR5PIK3CARPA1NAMPT
SCHEMBL5979134 0.90 NAMPT (0.35) MALT1WDR5PIK3CACSF1RRPA1
SCHEMBL14416571 0.90 RPA1 (0.36) MALT1WDR5L3MBTL1PIK3CACSF1R
SCHEMBL5528562 0.89 SMO (0.41) MALT1CSF1RRPA1NAMPTP2RX7
SCHEMBL5520734 0.88 SMO (0.39) NAMPT
SCHEMBL5517681 0.87 MALT1 (0.35) MALT1WDR5RPA1NAMPTP2RX7
SCHEMBL5522089 0.86 MALT1 (0.35) MALT1RPA1CCNE1CDK2GSK3B
SCHEMBL5533378 0.86 MEN1 (0.41) WDR5NAMPT
SCHEMBL5525488 0.85 NAMPT (0.40) NAMPT

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 5 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
US-20070219210-A1 Amidopyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-09-20 US disclosed
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 3117/4885WDR5 2672/4885L3MBTL1 3071/4885

“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.